AdrianM0/SMILES-to-IUPAC-BOOTSTRAP-ROUND-43

SMILES stringlengths 2 1.64k	IUPAC stringlengths 6 1.48k
Cc1cc(-c2ccc(C#COC=O)s2)ccn1	2-[5-(2-methylpyridin-4-yl)thiophen-2-yl]ethynyl formate
Cc1ccc(C(=O)N2CCCN(C(=O)c3cccs3)CC2)cc1C	(3,4-dimethylphenyl)-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]methanone
OC(Cc1ccccc1Cl)(C[N+]1=NCCC1=S)C1(Cl)CC1	1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-3,4-dihydropyrazol-1-ium-5-thione
COc1ccc(C(=O)Nc2[nH]ncc2C(N)=NO)cc1F	3-fluoro-N-[4-(N'-hydroxycarbamimidoyl)-1H-pyrazol-5-yl]-4-methoxybenzamide
Cc1cccc(-c2cc(-c3ccc(C(C)C)cc3)c(C#N)c(N)n2)c1	2-amino-6-(3-methylphenyl)-4-(4-propan-2-ylphenyl)pyridine-3-carbonitrile
Cc1c(Cl)cccc1NC(=O)c1ccc(N2CCN(C)CC2)nn1	N-(3-chloro-2-methylphenyl)-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide
COC(=O)c1ccc(Cl)c(NC(=O)c2sc(-c3cccs3)nc2C)c1	methyl 4-chloro-3-[(4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carbonyl)amino]benzoate
CC(O)c1ccc(C(C)(C)C(=O)O)cc1	2-[4-(1-hydroxyethyl)phenyl]-2-methylpropanoic acid
Cc1cc(NC(=O)C2(c3cc(-c4ccccc4)on3)CC2)no1	N-(5-methyl-1,2-oxazol-3-yl)-1-(5-phenyl-1,2-oxazol-3-yl)cyclopropane-1-carboxamide
CCCOc1ccc(C(CN)N(CCOC)C2CC2)cc1	N-cyclopropyl-N-(2-methoxyethyl)-1-(4-propoxyphenyl)ethane-1,2-diamine
O=C(Cc1csc(-c2cccnc2)n1)Nc1cccnc1N1CCOCC1	N-(2-morpholin-4-ylpyridin-3-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
CC(CN)CC(=O)Cc1ccc(C(C)C)cc1	5-amino-4-methyl-1-(4-propan-2-ylphenyl)pentan-2-one
CC(=O)C1(N)C=CNC(=O)N1	4-acetyl-4-amino-1,3-dihydropyrimidin-2-one
COc1cccc(CC(=O)N2CCCN(C3=Nc4ccc(C)cc4Oc4cc(OC)ccc43)CC2)c1	1-[4-(9-methoxy-2-methylbenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-2-(3-methoxyphenyl)ethanone
CCOC(=O)Nc1cc(CCC(=O)O)ccc1[N+](=O)[O-]	3-[3-(ethoxycarbonylamino)-4-nitrophenyl]propanoic acid
CC1CN(S(=O)(=O)c2cccc(C(=O)OCC(=O)Nc3ccccc3OC(F)F)c2)CC(C)O1	[2-[2-(difluoromethoxy)anilino]-2-oxoethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate
CCc1cc(Br)ccc1N1C(=O)[C@H]2[C@@H]3CC[C@@H](C3)[C@@H]2C1=O	(1S,2S,6S,7R)-4-(4-bromo-2-ethylphenyl)-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
CCCCC(CC)(OCCOCCOC)C(OCCOCCOC)(OCCOCCOC)C(=O)C(OCCOCCOC)(OCCOCCOC)C(CC)(CCCC)OCCOCCOC	5,9-diethyl-5,6,6,8,8,9-hexakis[2-(2-methoxyethoxy)ethoxy]tridecan-7-one
CN/C=C(\SC)C(C)C	(Z)-N,3-dimethyl-2-methylsulfanylbut-1-en-1-amine
COc1ccc(C(O)CN(C)C(=O)NCC(C)C)cc1	1-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-1-methyl-3-(2-methylpropyl)urea
CNS(=O)(=O)c1ccc(Oc2ccc(C)c(F)c2)c(N)c1	3-amino-4-(3-fluoro-4-methylphenoxy)-N-methylbenzenesulfonamide
CCN1C(=O)/C(=C\c2cc(Br)c(OC)cc2OC)SC1=Nc1ccccc1	(5E)-5-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-3-ethyl-2-phenylimino-1,3-thiazolidin-4-one
CC(=O)S[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2OC1CCCCO1.Cc1ccc(S(=O)(=O)O[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3OC2CCCCO2)cc1	S-[(3S,3aR,6R,6aS)-3-(oxan-2-yloxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ethanethioate;[(3S,3aR,6S,6aS)-3-(oxan-2-yloxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] 4-methylbenzenesulfonate
CC(C)(C)c1ncc(C(=O)O)cc1N	5-amino-6-tert-butylpyridine-3-carboxylic acid
CCc1ccc2c(c1)C(N)C(=O)N2CC	3-amino-1,5-diethyl-3H-indol-2-one
CC[C@@H](C(=O)NC(=O)CCl)N1CCCC1=O	(2S)-N-(2-chloroacetyl)-2-(2-oxopyrrolidin-1-yl)butanamide
Cc1nc(C(C)(C)NC(=O)c2n[nH]c(=O)c3ccccc23)sc1C	N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]-4-oxo-3H-phthalazine-1-carboxamide
C[Si](C)(C)c1oc2c(c1-c1ccccc1)C(=O)c1ccccc1C2=O	3-phenyl-2-trimethylsilylbenzo[f][1]benzofuran-4,9-dione
O=C(COc1ccccc1)N=C1S[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccccc1	N-[(3aS,6aS)-5,5-dioxo-3-phenyl-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-phenoxyacetamide
NC(=O)c1cnc2[nH]ccc2n1	5H-pyrrolo[2,3-b]pyrazine-2-carboxamide
Clc1cccc2ncnc(Cl)c12.Clc1cccc2ncnc(N3CCCCC3c3cc4nc(N5CCC5)cc(N5CCOCC5)n4n3)c12.PPP(P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P.c1c(N2CCC2)nc2cc(C3CCCCN3)nn2c1N1CCOCC1	4-[5-(azetidin-1-yl)-2-[1-(5-chloroquinazolin-4-yl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidin-7-yl]morpholine;4-[5-(azetidin-1-yl)-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]morpholine;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[diphosphanyl(phosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;4,5-dichloroquinazoline
COCc1ccc(Cn2c(Oc3cccc(OC(F)(F)F)c3)nc3c2c(=O)n(C)c(=O)n3C)cc1	7-[[4-(methoxymethyl)phenyl]methyl]-1,3-dimethyl-8-[3-(trifluoromethoxy)phenoxy]purine-2,6-dione
CCCNC(c1ccco1)c1ncc(C)cc1C	N-[(3,5-dimethylpyridin-2-yl)-(furan-2-yl)methyl]propan-1-amine
CC1(C(=O)NC2CC(O)C2)CCCS1	N-(3-hydroxycyclobutyl)-2-methylthiolane-2-carboxamide
NCCOCCOCCOCCOCCNNC(=O)CCCc1c[nH]c2ccccc12	N'-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethyl]-4-(1H-indol-3-yl)butanehydrazide
Cc1nccn1CCCN(C)C	N,N-dimethyl-3-(2-methylimidazol-1-yl)propan-1-amine
COc1ccc(/C=C(/C)C(=O)O)cc1OC	(Z)-3-(3,4-dimethoxyphenyl)-2-methylprop-2-enoic acid
O=C(NCCC(=O)N1CCC(c2nc3ccccc3s2)CC1)Nc1ccc(Br)cc1	1-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxopropyl]-3-(4-bromophenyl)urea
CC(C)CCCCCCNC(=O)N1CCCCC1C(=O)O	1-(7-methyloctylcarbamoyl)piperidine-2-carboxylic acid
C1CCOCC1.C=C(/C=C(\C=C(C)C)C(=O)N1CCC[C@H]1CC)N(C)CCc1ccccc1.CCCCCC	(2E)-1-[(2R)-2-ethylpyrrolidin-1-yl]-4-[methyl(2-phenylethyl)amino]-2-(2-methylprop-1-enyl)penta-2,4-dien-1-one;hexane;oxane
CC.CC1CC=CC(S)CC1	ethane;5-methylcyclohept-2-ene-1-thiol
NC1(Cc2cc3c(cc2Cl)COCO3)CC1	1-[(6-chloro-4H-1,3-benzodioxin-7-yl)methyl]cyclopropan-1-amine
CN=C(NCc1cc(C(C)C)no1)NCc1nc(C)c(C)s1	1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methyl-3-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]guanidine
C[n+]1c(SCC(=O)Nc2ccc(N3CCN(C(=O)c4ccccc4Br)CC3)cc2)[nH]c2ccccc21	N-[4-[4-(2-bromobenzoyl)piperazin-1-yl]phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide
O=[N+]([O-])c1ccc[nH+]c1N1CCN(S(=O)(=O)c2ccccc2F)CC1	1-(2-fluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine
CCN1C(=O)/C(=C2/Sc3ccc(OC)cc3N2C)SC1=Nc1cccc(C)c1	(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-(3-methylphenyl)imino-1,3-thiazolidin-4-one
Cc1c(O)cccc1C(=O)NC(Cc1ccccc1)C(O)C(=O)N1COC(C)(C)C1C(=O)NCC#N	N-(cyanomethyl)-3-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]-5,5-dimethyl-1,3-oxazolidine-4-carboxamide
CCCOc1cc(S(=O)(=O)N2CCCCC2)c(C)cc1C	1-(2,4-dimethyl-5-propoxyphenyl)sulfonylpiperidine
CS(=O)(=O)c1ccc(Nc2nn(-c3ccc(S(C)(=O)=O)cc3)cc2C(N)=O)cc1	3-(4-methylsulfonylanilino)-1-(4-methylsulfonylphenyl)pyrazole-4-carboxamide
Cn1cncc1-c1cn(Cc2ccc3cc(C(=O)Nc4ccccc4N)sc3c2)nn1	N-(2-aminophenyl)-6-[[4-(3-methylimidazol-4-yl)triazol-1-yl]methyl]-1-benzothiophene-2-carboxamide
NC(=O)C1CCN(C(=O)c2occc2Br)CC1	1-(3-bromofuran-2-carbonyl)piperidine-4-carboxamide
CCNC(=S)N/N=C/c1cc(Cl)c(OC(C)C)c(OCC)c1	1-[(E)-(3-chloro-5-ethoxy-4-propan-2-yloxyphenyl)methylideneamino]-3-ethylthiourea
Cc1cn(-c2ccc(-c3c(Cl)nn4cc(-c5cc(F)ccc5C)nc4c3N)cc2F)cn1	6-chloro-7-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-2-(5-fluoro-2-methylphenyl)imidazo[1,2-b]pyridazin-8-amine
O=C(COc1cccc(F)c1)N1CCN(S(=O)(=O)c2ccc(F)c(F)c2F)CC1	2-(3-fluorophenoxy)-1-[4-(2,3,4-trifluorophenyl)sulfonylpiperazin-1-yl]ethanone
COc1cc(/C=C2/NC(=O)N(Cc3ccc(Br)cc3)C2=O)cc(I)c1OCc1ccc(Cl)cc1Cl	(5E)-3-[(4-bromophenyl)methyl]-5-[[4-[(2,4-dichlorophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylidene]imidazolidine-2,4-dione
Cc1cccc(CCl)c1C(=O)CCBr	3-bromo-1-[2-(chloromethyl)-6-methylphenyl]propan-1-one
CCC1CCC(CN)(OC2CCCc3ccccc32)CC1	[4-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclohexyl]methanamine
Cc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3ccccc3OCCc3ccccc3)CC2)cc1C	1-(3,4-dimethylphenyl)sulfonyl-N-[2-(2-phenylethoxy)phenyl]piperidine-4-carboxamide
O=C(O)C1CN(Cc2ccc(F)cc2Cl)CCO1	4-[(2-chloro-4-fluorophenyl)methyl]morpholine-2-carboxylic acid
CCN(C(=O)COc1ccc2ccc(=O)oc2c1)C1=CCCCC1	N-(cyclohexen-1-yl)-N-ethyl-2-(2-oxochromen-7-yl)oxyacetamide
CCO[Si](CCCNC(=O)C(F)(F)OCF)(OCC)OCC	2,2-difluoro-2-(fluoromethoxy)-N-(3-triethoxysilylpropyl)acetamide
CCO[P+](=O)C(c1cnnc2ccccc12)P(=O)(OCC)OCC	[cinnolin-4-yl(diethoxyphosphoryl)methyl]-ethoxy-oxophosphanium
COCCCSc1ccc(CNCCOC)cn1	2-methoxy-N-[[6-(3-methoxypropylsulfanyl)pyridin-3-yl]methyl]ethanamine
CCCNc1ccc(S(=O)(=O)NC2CCCCC2C)cc1	N-(2-methylcyclohexyl)-4-(propylamino)benzenesulfonamide
COC(=O)Cl.COC(=O)Cl.COC([NH-])=O.COC([NH-])=O.[CH2-]PC.[CH2-]PC.[CH2-]P[CH2-].[CH2-]P[CH2-].[CH2-]P[CH2-].[CH2-]P[CH2-].[CH2-]P[CH2-].[CH3-].[CH3-].[CH3-].[CH3-].[NH2-].[NH2-].[V+2].[V+2].[V+2].[V+2].[V+2].[W+2].[W+2].[W+2].[W+2].[W+2]	azanide;carbanide;dimethanidylphosphane;methanidyl(methyl)phosphane;methoxycarbonylazanide;methyl carbonochloridate;tungsten(2+);vanadium(2+)
Cc1ccc(OCC(=O)N2CCC(C(=O)N3CCCC(C)C3)CC2)nc1	1-[4-(3-methylpiperidine-1-carbonyl)piperidin-1-yl]-2-(5-methylpyridin-2-yl)oxyethanone
Cc1ncc(Cl)c(NCCCc2csc(N)n2)n1	4-[3-[(5-chloro-2-methylpyrimidin-4-yl)amino]propyl]-1,3-thiazol-2-amine
COc1cccc(NC(=O)CC2SC3=NCCCN3C2=O)c1	N-(3-methoxyphenyl)-2-(3-oxo-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-yl)acetamide
Cc1ccc(CN2CC(C(=O)NC3(c4cccc(Br)c4)CCOCC3)CC2=O)cc1	N-[4-(3-bromophenyl)oxan-4-yl]-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CC1(C)ON(c2ccc(O)cc2)OC1(C)C	4-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)phenol
CC(C)(C)OC(=O)NCC(Cc1nccc(-c2[nH]nc3nc(NCCN4CCOCC4)ncc23)n1)c1ccsc1	tert-butyl N-[3-[4-[6-(2-morpholin-4-ylethylamino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]pyrimidin-2-yl]-2-thiophen-3-ylpropyl]carbamate
CCCCN1C(=O)C(Cl)=C(Cl)C1=O.CCCCN1C(=O)C(P(C(C)C)C(C)C)=C(P2[C@H](C)CC[C@H]2C)C1=O.CCCCN1C(=O)C([PH+](C(C)C)C(C)C)=C([PH+]2[C@H](C)CC[C@H]2C)C1=O.FB(F)F.[C-]1=CCCC=[C-]CC1.[F-].[Rh+2]	1-butyl-3,4-dichloropyrrole-2,5-dione;[1-butyl-4-[(2R,5R)-2,5-dimethylphospholan-1-ium-1-yl]-2,5-dioxopyrrol-3-yl]-di(propan-2-yl)phosphanium;1-butyl-3-[(2R,5R)-2,5-dimethylphospholan-1-yl]-4-di(propan-2-yl)phosphanylpyrrole-2,5-dione;cycloocta-1,5-diene;rhodium(2+);trifluoroborane;fluoride
CCCCCCCC/C=C\CCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\C=C/CCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCC	[1-[(9Z,11Z)-henicosa-9,11-dienoyl]oxy-3-[(Z)-hexadec-7-enoyl]oxypropan-2-yl] henicosanoate
Cc1ccc(NN2C(=O)C3CC4C(=CCC5C(=O)N(c6ccc([N+](=O)[O-])cc6)C(=O)C54)C(c4cc(Br)ccc4O)C3(c3ccccc3)C2=O)cc1	6-(5-bromo-2-hydroxyphenyl)-8-(4-methylanilino)-2-(4-nitrophenyl)-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
C=CC[C@@H](N)COc1cc(C(=O)OC)cc([N+](=O)[O-])c1Cl	methyl 3-[(2R)-2-aminopent-4-enoxy]-4-chloro-5-nitrobenzoate
Cc1ccc(-c2c(CC(=O)O)c(C)cc3nc(-c4ccc5c(c4)c(N4CCCC4)nn5C)sc23)cc1	2-[5-methyl-7-(4-methylphenyl)-2-(1-methyl-3-pyrrolidin-1-ylindazol-5-yl)-1,3-benzothiazol-6-yl]acetic acid
CCc1ccc(C(=O)OC)c(OS(=O)(=O)F)c1	methyl 4-ethyl-2-fluorosulfonyloxybenzoate
CCNc1nc(N2CCCC2(C)C)nc(-n2cccn2)n1	4-(2,2-dimethylpyrrolidin-1-yl)-N-ethyl-6-pyrazol-1-yl-1,3,5-triazin-2-amine
C.CC#N.CC(=O)OC[C@H]1OC(Br)C(OC(C)=O)[C@H]1OC(C)=O.CC(=O)OC[C@H]1O[C@@H](n2cnc(N)nc2=O)C(OC(C)=O)[C@H]1OC(C)=O.CO.C[Si](C)(C)Nc1ncnc(O[Si](C)(C)C)n1.N.Nc1ncn([C@@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1.Nc1ncnc(=O)[nH]1	acetonitrile;4-amino-1-[(2R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3,5-triazin-2-one;6-amino-1H-1,3,5-triazin-2-one;azane;[(2R,3S,5R)-3,4-diacetyloxy-5-(4-amino-2-oxo-1,3,5-triazin-1-yl)oxolan-2-yl]methyl acetate;[(2R,3S)-3,4-diacetyloxy-5-bromooxolan-2-yl]methyl acetate;methane;methanol;N-trimethylsilyl-4-trimethylsilyloxy-1,3,5-triazin-2-amine
Cc1cc(OC(=O)[C@H](Cc2ccccc2)N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@H]45)[C@@H]3C2=O)cc2oc(=O)ccc12	(5-methyl-2-oxochromen-7-yl) (2S)-2-[(1S,2R,6S,7S,8R,10S)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-3-phenylpropanoate
Cc1nnc(SCC2OC(c3ccc(-c4ccccc4CNC(=O)c4c(F)c(F)c(F)c(F)c4F)cc3)OC(c3ccc(CO)cc3)C2C)s1	2,3,4,5,6-pentafluoro-N-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide
CCCCOC(=O)C(Nc1ccc(/C(N)=N/O)cc1)c1cc(OCC)cc(OCC)c1F	butyl 2-(3,5-diethoxy-2-fluorophenyl)-2-[4-[(Z)-N'-hydroxycarbamimidoyl]anilino]acetate
CC1CN(Cc2ccc(N)c3cccnc23)CCCO1	8-[(2-methyl-1,4-oxazepan-4-yl)methyl]quinolin-5-amine
FC(F)(F)c1ccc(N2CCN(C(c3cn[nH]c3)c3ccccc3Br)CC2)nc1	1-[(2-bromophenyl)-(1H-pyrazol-4-yl)methyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine
Fc1ccc(NC(=S)N/N=C/c2ccc(Oc3ccc(Cl)cc3)cc2)cc1	1-[(E)-[4-(4-chlorophenoxy)phenyl]methylideneamino]-3-(4-fluorophenyl)thiourea
Cc1nnc(SCC2=C(C(=O)O)N3C(=O)[C@@H](NC(=O)CNc4ccc(O)cc4)[C@@H]3SC2)s1	(6S,7R)-7-[[2-(4-hydroxyanilino)acetyl]amino]-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CC(C)[C@](C)(C#N)NC(=O)COC(=O)c1cccnc1Sc1ccccc1Cl	[2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate
COc1ccc(CCC(=O)c2ccc(N)cc2Br)cc1	1-(4-amino-2-bromophenyl)-3-(4-methoxyphenyl)propan-1-one
Cc1cc(Cl)cc(C(=O)NCCCCC(=O)O)c1	5-[(3-chloro-5-methylbenzoyl)amino]pentanoic acid
CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(N(C)Cc3ccc(-c4cn(CCCCCC(=O)NO)nn4)cc3)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O	6-[4-[4-[[[2-[[14-ethyl-12,13-dihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-3-hydroxy-6-methyloxan-4-yl]-methylamino]methyl]phenyl]triazol-1-yl]-N-hydroxyhexanamide
CC/C=C/CC/C=C/CCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCC/C=C\C/C=C\CCCCCCCCCCCCC	(21Z,24Z)-2-hydroxy-N-[(8E,12E)-1,3,4-trihydroxypentadeca-8,12-dien-2-yl]octatriaconta-21,24-dienamide
Cc1nn(Cc2ccc(Cl)cc2Cl)c(C)c1NC(=O)c1sc2ccccc2c1Cl	3-chloro-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-1-benzothiophene-2-carboxamide
Cc1nc(S(=O)(=O)N[C@H](C)C[C@@H](O)c2ccco2)cn1C	N-[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]-1,2-dimethylimidazole-4-sulfonamide
c1cc(CCNCCN2CCOCC2)ccn1	N-(2-morpholin-4-ylethyl)-2-pyridin-4-ylethanamine
CC(C(N)=NO)N(C)C(=O)c1cnns1	N-(1-amino-1-hydroxyiminopropan-2-yl)-N-methylthiadiazole-5-carboxamide
CCOc1c(Cl)cc(/C=C/C(=O)OCC(=O)Nc2ccccc2OC)cc1OC	[2-(2-methoxyanilino)-2-oxoethyl] (E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)prop-2-enoate
Cc1ccc(CCC(=O)NC(C)c2ccc(Cl)s2)c(C)c1	N-[1-(5-chlorothiophen-2-yl)ethyl]-3-(2,4-dimethylphenyl)propanamide
[N-]=[N+]=NCC1Cc2[nH]c(-c3ccnc(N)n3)cc2C(=O)N1	2-(2-aminopyrimidin-4-yl)-6-(azidomethyl)-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
Cc1cccc(-c2nc(Nc3cc(C)[nH]n3)c3ccc(C(=O)CN)cc3n2)c1	2-amino-1-[2-(3-methylphenyl)-4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-7-yl]ethanone
CN(C[C@H]1Cc2c(cccc2CC(=O)CN2CCOCC2)CN1)[C@H]1CCCc2cccnc21	1-[(3R)-3-[[methyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]methyl]-1,2,3,4-tetrahydroisoquinolin-5-yl]-3-morpholin-4-ylpropan-2-one

Cc1cc(-c2ccc(C#COC=O)s2)ccn1

2-[5-(2-methylpyridin-4-yl)thiophen-2-yl]ethynyl formate

Cc1ccc(C(=O)N2CCCN(C(=O)c3cccs3)CC2)cc1C

(3,4-dimethylphenyl)-[4-(thiophene-2-carbonyl)-1,4-diazepan-1-yl]methanone

OC(Cc1ccccc1Cl)(C[N+]1=NCCC1=S)C1(Cl)CC1

1-[2-(1-chlorocyclopropyl)-3-(2-chlorophenyl)-2-hydroxypropyl]-3,4-dihydropyrazol-1-ium-5-thione

COc1ccc(C(=O)Nc2[nH]ncc2C(N)=NO)cc1F

3-fluoro-N-[4-(N'-hydroxycarbamimidoyl)-1H-pyrazol-5-yl]-4-methoxybenzamide

Cc1cccc(-c2cc(-c3ccc(C(C)C)cc3)c(C#N)c(N)n2)c1

2-amino-6-(3-methylphenyl)-4-(4-propan-2-ylphenyl)pyridine-3-carbonitrile

Cc1c(Cl)cccc1NC(=O)c1ccc(N2CCN(C)CC2)nn1

N-(3-chloro-2-methylphenyl)-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide

COC(=O)c1ccc(Cl)c(NC(=O)c2sc(-c3cccs3)nc2C)c1

methyl 4-chloro-3-[(4-methyl-2-thiophen-2-yl-1,3-thiazole-5-carbonyl)amino]benzoate

CC(O)c1ccc(C(C)(C)C(=O)O)cc1

2-[4-(1-hydroxyethyl)phenyl]-2-methylpropanoic acid

Cc1cc(NC(=O)C2(c3cc(-c4ccccc4)on3)CC2)no1

N-(5-methyl-1,2-oxazol-3-yl)-1-(5-phenyl-1,2-oxazol-3-yl)cyclopropane-1-carboxamide

CCCOc1ccc(C(CN)N(CCOC)C2CC2)cc1

N-cyclopropyl-N-(2-methoxyethyl)-1-(4-propoxyphenyl)ethane-1,2-diamine

O=C(Cc1csc(-c2cccnc2)n1)Nc1cccnc1N1CCOCC1

N-(2-morpholin-4-ylpyridin-3-yl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide

CC(CN)CC(=O)Cc1ccc(C(C)C)cc1

5-amino-4-methyl-1-(4-propan-2-ylphenyl)pentan-2-one

CC(=O)C1(N)C=CNC(=O)N1

4-acetyl-4-amino-1,3-dihydropyrimidin-2-one

COc1cccc(CC(=O)N2CCCN(C3=Nc4ccc(C)cc4Oc4cc(OC)ccc43)CC2)c1

1-[4-(9-methoxy-2-methylbenzo[b][1,4]benzoxazepin-6-yl)-1,4-diazepan-1-yl]-2-(3-methoxyphenyl)ethanone

CCOC(=O)Nc1cc(CCC(=O)O)ccc1[N+](=O)[O-]

3-[3-(ethoxycarbonylamino)-4-nitrophenyl]propanoic acid

CC1CN(S(=O)(=O)c2cccc(C(=O)OCC(=O)Nc3ccccc3OC(F)F)c2)CC(C)O1

[2-[2-(difluoromethoxy)anilino]-2-oxoethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

CCc1cc(Br)ccc1N1C(=O)[C@H]2[C@@H]3CC[C@@H](C3)[C@@H]2C1=O

(1S,2S,6S,7R)-4-(4-bromo-2-ethylphenyl)-4-azatricyclo[5.2.1.02,6]decane-3,5-dione

CCCCC(CC)(OCCOCCOC)C(OCCOCCOC)(OCCOCCOC)C(=O)C(OCCOCCOC)(OCCOCCOC)C(CC)(CCCC)OCCOCCOC

5,9-diethyl-5,6,6,8,8,9-hexakis[2-(2-methoxyethoxy)ethoxy]tridecan-7-one

CN/C=C(\SC)C(C)C

(Z)-N,3-dimethyl-2-methylsulfanylbut-1-en-1-amine

COc1ccc(C(O)CN(C)C(=O)NCC(C)C)cc1

1-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-1-methyl-3-(2-methylpropyl)urea

CNS(=O)(=O)c1ccc(Oc2ccc(C)c(F)c2)c(N)c1

3-amino-4-(3-fluoro-4-methylphenoxy)-N-methylbenzenesulfonamide

CCN1C(=O)/C(=C\c2cc(Br)c(OC)cc2OC)SC1=Nc1ccccc1

(5E)-5-[(5-bromo-2,4-dimethoxyphenyl)methylidene]-3-ethyl-2-phenylimino-1,3-thiazolidin-4-one

CC(=O)S[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2OC1CCCCO1.Cc1ccc(S(=O)(=O)O[C@H]2CO[C@H]3[C@@H]2OC[C@@H]3OC2CCCCO2)cc1

S-[(3S,3aR,6R,6aS)-3-(oxan-2-yloxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] ethanethioate;[(3S,3aR,6S,6aS)-3-(oxan-2-yloxy)-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] 4-methylbenzenesulfonate

CC(C)(C)c1ncc(C(=O)O)cc1N

5-amino-6-tert-butylpyridine-3-carboxylic acid

CCc1ccc2c(c1)C(N)C(=O)N2CC

3-amino-1,5-diethyl-3H-indol-2-one

CC[C@@H](C(=O)NC(=O)CCl)N1CCCC1=O

(2S)-N-(2-chloroacetyl)-2-(2-oxopyrrolidin-1-yl)butanamide

Cc1nc(C(C)(C)NC(=O)c2n[nH]c(=O)c3ccccc23)sc1C

N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)propan-2-yl]-4-oxo-3H-phthalazine-1-carboxamide

C[Si](C)(C)c1oc2c(c1-c1ccccc1)C(=O)c1ccccc1C2=O

3-phenyl-2-trimethylsilylbenzo[f][1]benzofuran-4,9-dione

O=C(COc1ccccc1)N=C1S[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccccc1

N-[(3aS,6aS)-5,5-dioxo-3-phenyl-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-2-ylidene]-2-phenoxyacetamide

NC(=O)c1cnc2[nH]ccc2n1

5H-pyrrolo[2,3-b]pyrazine-2-carboxamide

Clc1cccc2ncnc(Cl)c12.Clc1cccc2ncnc(N3CCCCC3c3cc4nc(N5CCC5)cc(N5CCOCC5)n4n3)c12.PPP(P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P(P)P)P(P)P)P(P(P)P)P(P)P.c1c(N2CCC2)nc2cc(C3CCCCN3)nn2c1N1CCOCC1

4-[5-(azetidin-1-yl)-2-[1-(5-chloroquinazolin-4-yl)piperidin-2-yl]pyrazolo[1,5-a]pyrimidin-7-yl]morpholine;4-[5-(azetidin-1-yl)-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidin-7-yl]morpholine;bis[bis[bis(phosphanyl)phosphanyl]phosphanyl]-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[bis[bis(phosphanyl)phosphanyl]phosphanyl-[diphosphanyl(phosphanyl)phosphanyl]phosphanyl]phosphanyl]phosphane;4,5-dichloroquinazoline

COCc1ccc(Cn2c(Oc3cccc(OC(F)(F)F)c3)nc3c2c(=O)n(C)c(=O)n3C)cc1

7-[[4-(methoxymethyl)phenyl]methyl]-1,3-dimethyl-8-[3-(trifluoromethoxy)phenoxy]purine-2,6-dione

CCCNC(c1ccco1)c1ncc(C)cc1C

N-[(3,5-dimethylpyridin-2-yl)-(furan-2-yl)methyl]propan-1-amine

CC1(C(=O)NC2CC(O)C2)CCCS1

N-(3-hydroxycyclobutyl)-2-methylthiolane-2-carboxamide

NCCOCCOCCOCCOCCNNC(=O)CCCc1c[nH]c2ccccc12

N'-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethyl]-4-(1H-indol-3-yl)butanehydrazide

Cc1nccn1CCCN(C)C

N,N-dimethyl-3-(2-methylimidazol-1-yl)propan-1-amine

COc1ccc(/C=C(/C)C(=O)O)cc1OC

(Z)-3-(3,4-dimethoxyphenyl)-2-methylprop-2-enoic acid

O=C(NCCC(=O)N1CCC(c2nc3ccccc3s2)CC1)Nc1ccc(Br)cc1

1-[3-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-oxopropyl]-3-(4-bromophenyl)urea

CC(C)CCCCCCNC(=O)N1CCCCC1C(=O)O

1-(7-methyloctylcarbamoyl)piperidine-2-carboxylic acid

C1CCOCC1.C=C(/C=C(\C=C(C)C)C(=O)N1CCC[C@H]1CC)N(C)CCc1ccccc1.CCCCCC

(2E)-1-[(2R)-2-ethylpyrrolidin-1-yl]-4-[methyl(2-phenylethyl)amino]-2-(2-methylprop-1-enyl)penta-2,4-dien-1-one;hexane;oxane

CC.CC1CC=CC(S)CC1

ethane;5-methylcyclohept-2-ene-1-thiol

NC1(Cc2cc3c(cc2Cl)COCO3)CC1

1-[(6-chloro-4H-1,3-benzodioxin-7-yl)methyl]cyclopropan-1-amine

CN=C(NCc1cc(C(C)C)no1)NCc1nc(C)c(C)s1

1-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-methyl-3-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]guanidine

C[n+]1c(SCC(=O)Nc2ccc(N3CCN(C(=O)c4ccccc4Br)CC3)cc2)[nH]c2ccccc21

N-[4-[4-(2-bromobenzoyl)piperazin-1-yl]phenyl]-2-[(3-methyl-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide

O=[N+]([O-])c1ccc[nH+]c1N1CCN(S(=O)(=O)c2ccccc2F)CC1

1-(2-fluorophenyl)sulfonyl-4-(3-nitropyridin-1-ium-2-yl)piperazine

CCN1C(=O)/C(=C2/Sc3ccc(OC)cc3N2C)SC1=Nc1cccc(C)c1

(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2-ylidene)-2-(3-methylphenyl)imino-1,3-thiazolidin-4-one

Cc1c(O)cccc1C(=O)NC(Cc1ccccc1)C(O)C(=O)N1COC(C)(C)C1C(=O)NCC#N

N-(cyanomethyl)-3-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]-5,5-dimethyl-1,3-oxazolidine-4-carboxamide

CCCOc1cc(S(=O)(=O)N2CCCCC2)c(C)cc1C

1-(2,4-dimethyl-5-propoxyphenyl)sulfonylpiperidine

CS(=O)(=O)c1ccc(Nc2nn(-c3ccc(S(C)(=O)=O)cc3)cc2C(N)=O)cc1

3-(4-methylsulfonylanilino)-1-(4-methylsulfonylphenyl)pyrazole-4-carboxamide

Cn1cncc1-c1cn(Cc2ccc3cc(C(=O)Nc4ccccc4N)sc3c2)nn1

N-(2-aminophenyl)-6-[[4-(3-methylimidazol-4-yl)triazol-1-yl]methyl]-1-benzothiophene-2-carboxamide

NC(=O)C1CCN(C(=O)c2occc2Br)CC1

1-(3-bromofuran-2-carbonyl)piperidine-4-carboxamide

CCNC(=S)N/N=C/c1cc(Cl)c(OC(C)C)c(OCC)c1

1-[(E)-(3-chloro-5-ethoxy-4-propan-2-yloxyphenyl)methylideneamino]-3-ethylthiourea

Cc1cn(-c2ccc(-c3c(Cl)nn4cc(-c5cc(F)ccc5C)nc4c3N)cc2F)cn1

6-chloro-7-[3-fluoro-4-(4-methylimidazol-1-yl)phenyl]-2-(5-fluoro-2-methylphenyl)imidazo[1,2-b]pyridazin-8-amine

O=C(COc1cccc(F)c1)N1CCN(S(=O)(=O)c2ccc(F)c(F)c2F)CC1

2-(3-fluorophenoxy)-1-[4-(2,3,4-trifluorophenyl)sulfonylpiperazin-1-yl]ethanone

COc1cc(/C=C2/NC(=O)N(Cc3ccc(Br)cc3)C2=O)cc(I)c1OCc1ccc(Cl)cc1Cl

(5E)-3-[(4-bromophenyl)methyl]-5-[[4-[(2,4-dichlorophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylidene]imidazolidine-2,4-dione

Cc1cccc(CCl)c1C(=O)CCBr

3-bromo-1-[2-(chloromethyl)-6-methylphenyl]propan-1-one

CCC1CCC(CN)(OC2CCCc3ccccc32)CC1

[4-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yloxy)cyclohexyl]methanamine

Cc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3ccccc3OCCc3ccccc3)CC2)cc1C

1-(3,4-dimethylphenyl)sulfonyl-N-[2-(2-phenylethoxy)phenyl]piperidine-4-carboxamide

O=C(O)C1CN(Cc2ccc(F)cc2Cl)CCO1

4-[(2-chloro-4-fluorophenyl)methyl]morpholine-2-carboxylic acid

CCN(C(=O)COc1ccc2ccc(=O)oc2c1)C1=CCCCC1

N-(cyclohexen-1-yl)-N-ethyl-2-(2-oxochromen-7-yl)oxyacetamide

CCO[Si](CCCNC(=O)C(F)(F)OCF)(OCC)OCC

2,2-difluoro-2-(fluoromethoxy)-N-(3-triethoxysilylpropyl)acetamide

CCO[P+](=O)C(c1cnnc2ccccc12)P(=O)(OCC)OCC

[cinnolin-4-yl(diethoxyphosphoryl)methyl]-ethoxy-oxophosphanium

COCCCSc1ccc(CNCCOC)cn1

2-methoxy-N-[[6-(3-methoxypropylsulfanyl)pyridin-3-yl]methyl]ethanamine

CCCNc1ccc(S(=O)(=O)NC2CCCCC2C)cc1

N-(2-methylcyclohexyl)-4-(propylamino)benzenesulfonamide

COC(=O)Cl.COC(=O)Cl.COC([NH-])=O.COC([NH-])=O.[CH2-]PC.[CH2-]PC.[CH2-]P[CH2-].[CH2-]P[CH2-].[CH2-]P[CH2-].[CH2-]P[CH2-].[CH2-]P[CH2-].[CH3-].[CH3-].[CH3-].[CH3-].[NH2-].[NH2-].[V+2].[V+2].[V+2].[V+2].[V+2].[W+2].[W+2].[W+2].[W+2].[W+2]

azanide;carbanide;dimethanidylphosphane;methanidyl(methyl)phosphane;methoxycarbonylazanide;methyl carbonochloridate;tungsten(2+);vanadium(2+)

Cc1ccc(OCC(=O)N2CCC(C(=O)N3CCCC(C)C3)CC2)nc1

1-[4-(3-methylpiperidine-1-carbonyl)piperidin-1-yl]-2-(5-methylpyridin-2-yl)oxyethanone

Cc1ncc(Cl)c(NCCCc2csc(N)n2)n1

4-[3-[(5-chloro-2-methylpyrimidin-4-yl)amino]propyl]-1,3-thiazol-2-amine

COc1cccc(NC(=O)CC2SC3=NCCCN3C2=O)c1

N-(3-methoxyphenyl)-2-(3-oxo-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-yl)acetamide

Cc1ccc(CN2CC(C(=O)NC3(c4cccc(Br)c4)CCOCC3)CC2=O)cc1

N-[4-(3-bromophenyl)oxan-4-yl]-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxamide

CC1(C)ON(c2ccc(O)cc2)OC1(C)C

4-(4,4,5,5-tetramethyl-1,3,2-dioxazolidin-2-yl)phenol

CC(C)(C)OC(=O)NCC(Cc1nccc(-c2[nH]nc3nc(NCCN4CCOCC4)ncc23)n1)c1ccsc1

tert-butyl N-[3-[4-[6-(2-morpholin-4-ylethylamino)-2H-pyrazolo[3,4-d]pyrimidin-3-yl]pyrimidin-2-yl]-2-thiophen-3-ylpropyl]carbamate

CCCCN1C(=O)C(Cl)=C(Cl)C1=O.CCCCN1C(=O)C(P(C(C)C)C(C)C)=C(P2[C@H](C)CC[C@H]2C)C1=O.CCCCN1C(=O)C([PH+](C(C)C)C(C)C)=C([PH+]2[C@H](C)CC[C@H]2C)C1=O.FB(F)F.[C-]1=CCCC=[C-]CC1.[F-].[Rh+2]

1-butyl-3,4-dichloropyrrole-2,5-dione;[1-butyl-4-[(2R,5R)-2,5-dimethylphospholan-1-ium-1-yl]-2,5-dioxopyrrol-3-yl]-di(propan-2-yl)phosphanium;1-butyl-3-[(2R,5R)-2,5-dimethylphospholan-1-yl]-4-di(propan-2-yl)phosphanylpyrrole-2,5-dione;cycloocta-1,5-diene;rhodium(2+);trifluoroborane;fluoride

CCCCCCCC/C=C\CCCCCC(=O)OCC(COC(=O)CCCCCCC/C=C\C=C/CCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCCC

[1-[(9Z,11Z)-henicosa-9,11-dienoyl]oxy-3-[(Z)-hexadec-7-enoyl]oxypropan-2-yl] henicosanoate

Cc1ccc(NN2C(=O)C3CC4C(=CCC5C(=O)N(c6ccc([N+](=O)[O-])cc6)C(=O)C54)C(c4cc(Br)ccc4O)C3(c3ccccc3)C2=O)cc1

6-(5-bromo-2-hydroxyphenyl)-8-(4-methylanilino)-2-(4-nitrophenyl)-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone

C=CC[C@@H](N)COc1cc(C(=O)OC)cc([N+](=O)[O-])c1Cl

methyl 3-[(2R)-2-aminopent-4-enoxy]-4-chloro-5-nitrobenzoate

Cc1ccc(-c2c(CC(=O)O)c(C)cc3nc(-c4ccc5c(c4)c(N4CCCC4)nn5C)sc23)cc1

2-[5-methyl-7-(4-methylphenyl)-2-(1-methyl-3-pyrrolidin-1-ylindazol-5-yl)-1,3-benzothiazol-6-yl]acetic acid

CCc1ccc(C(=O)OC)c(OS(=O)(=O)F)c1

methyl 4-ethyl-2-fluorosulfonyloxybenzoate

CCNc1nc(N2CCCC2(C)C)nc(-n2cccn2)n1

4-(2,2-dimethylpyrrolidin-1-yl)-N-ethyl-6-pyrazol-1-yl-1,3,5-triazin-2-amine

C.CC#N.CC(=O)OC[C@H]1OC(Br)C(OC(C)=O)[C@H]1OC(C)=O.CC(=O)OC[C@H]1O[C@@H](n2cnc(N)nc2=O)C(OC(C)=O)[C@H]1OC(C)=O.CO.C[Si](C)(C)Nc1ncnc(O[Si](C)(C)C)n1.N.Nc1ncn([C@@H]2O[C@H](CO)[C@H](O)C2O)c(=O)n1.Nc1ncnc(=O)[nH]1

acetonitrile;4-amino-1-[(2R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3,5-triazin-2-one;6-amino-1H-1,3,5-triazin-2-one;azane;[(2R,3S,5R)-3,4-diacetyloxy-5-(4-amino-2-oxo-1,3,5-triazin-1-yl)oxolan-2-yl]methyl acetate;[(2R,3S)-3,4-diacetyloxy-5-bromooxolan-2-yl]methyl acetate;methane;methanol;N-trimethylsilyl-4-trimethylsilyloxy-1,3,5-triazin-2-amine

Cc1cc(OC(=O)[C@H](Cc2ccccc2)N2C(=O)[C@@H]3[C@H]4C=C[C@@H]([C@@H]5C[C@H]45)[C@@H]3C2=O)cc2oc(=O)ccc12

(5-methyl-2-oxochromen-7-yl) (2S)-2-[(1S,2R,6S,7S,8R,10S)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-3-phenylpropanoate

Cc1nnc(SCC2OC(c3ccc(-c4ccccc4CNC(=O)c4c(F)c(F)c(F)c(F)c4F)cc3)OC(c3ccc(CO)cc3)C2C)s1

2,3,4,5,6-pentafluoro-N-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]benzamide

CCCCOC(=O)C(Nc1ccc(/C(N)=N/O)cc1)c1cc(OCC)cc(OCC)c1F

butyl 2-(3,5-diethoxy-2-fluorophenyl)-2-[4-[(Z)-N'-hydroxycarbamimidoyl]anilino]acetate

CC1CN(Cc2ccc(N)c3cccnc23)CCCO1

8-[(2-methyl-1,4-oxazepan-4-yl)methyl]quinolin-5-amine

FC(F)(F)c1ccc(N2CCN(C(c3cn[nH]c3)c3ccccc3Br)CC2)nc1

1-[(2-bromophenyl)-(1H-pyrazol-4-yl)methyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine

Fc1ccc(NC(=S)N/N=C/c2ccc(Oc3ccc(Cl)cc3)cc2)cc1

1-[(E)-[4-(4-chlorophenoxy)phenyl]methylideneamino]-3-(4-fluorophenyl)thiourea

Cc1nnc(SCC2=C(C(=O)O)N3C(=O)[C@@H](NC(=O)CNc4ccc(O)cc4)[C@@H]3SC2)s1

(6S,7R)-7-[[2-(4-hydroxyanilino)acetyl]amino]-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

CC(C)[C@](C)(C#N)NC(=O)COC(=O)c1cccnc1Sc1ccccc1Cl

[2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-(2-chlorophenyl)sulfanylpyridine-3-carboxylate

COc1ccc(CCC(=O)c2ccc(N)cc2Br)cc1

1-(4-amino-2-bromophenyl)-3-(4-methoxyphenyl)propan-1-one

Cc1cc(Cl)cc(C(=O)NCCCCC(=O)O)c1

5-[(3-chloro-5-methylbenzoyl)amino]pentanoic acid

CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(N(C)Cc3ccc(-c4cn(CCCCCC(=O)NO)nn4)cc3)C2O)C(C)(OC)CC(C)C(=O)C(C)C(O)C1(C)O

6-[4-[4-[[[2-[[14-ethyl-12,13-dihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-7-methoxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-3-hydroxy-6-methyloxan-4-yl]-methylamino]methyl]phenyl]triazol-1-yl]-N-hydroxyhexanamide

CC/C=C/CC/C=C/CCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCC/C=C\C/C=C\CCCCCCCCCCCCC

(21Z,24Z)-2-hydroxy-N-[(8E,12E)-1,3,4-trihydroxypentadeca-8,12-dien-2-yl]octatriaconta-21,24-dienamide

Cc1nn(Cc2ccc(Cl)cc2Cl)c(C)c1NC(=O)c1sc2ccccc2c1Cl

3-chloro-N-[1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-1-benzothiophene-2-carboxamide

Cc1nc(S(=O)(=O)N[C@H](C)C[C@@H](O)c2ccco2)cn1C

N-[(2R,4R)-4-(furan-2-yl)-4-hydroxybutan-2-yl]-1,2-dimethylimidazole-4-sulfonamide

c1cc(CCNCCN2CCOCC2)ccn1

N-(2-morpholin-4-ylethyl)-2-pyridin-4-ylethanamine

CC(C(N)=NO)N(C)C(=O)c1cnns1

N-(1-amino-1-hydroxyiminopropan-2-yl)-N-methylthiadiazole-5-carboxamide

CCOc1c(Cl)cc(/C=C/C(=O)OCC(=O)Nc2ccccc2OC)cc1OC

[2-(2-methoxyanilino)-2-oxoethyl] (E)-3-(3-chloro-4-ethoxy-5-methoxyphenyl)prop-2-enoate

Cc1ccc(CCC(=O)NC(C)c2ccc(Cl)s2)c(C)c1

N-[1-(5-chlorothiophen-2-yl)ethyl]-3-(2,4-dimethylphenyl)propanamide

[N-]=[N+]=NCC1Cc2[nH]c(-c3ccnc(N)n3)cc2C(=O)N1

2-(2-aminopyrimidin-4-yl)-6-(azidomethyl)-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one

Cc1cccc(-c2nc(Nc3cc(C)[nH]n3)c3ccc(C(=O)CN)cc3n2)c1

2-amino-1-[2-(3-methylphenyl)-4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-7-yl]ethanone

CN(C[C@H]1Cc2c(cccc2CC(=O)CN2CCOCC2)CN1)[C@H]1CCCc2cccnc21

1-[(3R)-3-[[methyl-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]amino]methyl]-1,2,3,4-tetrahydroisoquinolin-5-yl]-3-morpholin-4-ylpropan-2-one