FULL DB

Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )

STK781369
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-2-(2-fluorophenyl)acetamide
Smiles: O=C(Cc1ccccc1F)NCc1nc2c([nH]1)cccc2

STK686182
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-methylfuran-3-carboxamide
Smiles: O=C(c1ccoc1C)NCCc1nc2c([nH]1)cccc2

STK781375
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]pyrazine-2-carboxamide
Smiles: O=C(c1cnccn1)NCCc1nc2c([nH]1)cccc2

STK781378
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-methylquinoline-4-carboxamide
Smiles: Cc1nc2ccccc2c(c1)C(=O)NCCc1nc2c([nH]1)cccc2

STK781380
Synonyms: 3-(3,4-dimethoxyphenyl)-N-(thiophen-2-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(ccc1OC)c1noc(n1)C(=O)NCc1cccs1

STK686183
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCc1nc2c([nH]1)cccc2

STK781388
Synonyms: 6-(furan-2-ylmethyl)-1-(4-methoxyphenyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: COc1ccc(cc1)n1c(=S)[nH]c(=O)c2c1NCN(C2)Cc1ccco1

STK781392
Synonyms: 3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-(3,4,5-trimethoxybenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(CNC(=O)c2onc(n2)Cn2ncc(c2)[N+](=O)[O-])cc(c1OC)OC

STK781396
Synonyms: N-(2-ethoxybenzyl)-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: CCOc1ccccc1CNC(=O)c1onc(n1)c1ccc(cc1)n1cccc1

STK686185
Synonyms: 3-(5-methyl-1H-1,2,3-triazol-1-yl)-4-(1H-pyrrol-1-yl)-1,2,5-oxadiazole
Smiles: Cc1cnnn1c1nonc1n1cccc1

STK686186
Synonyms: 3-[5-(4-methoxyphenyl)-1H-1,2,3-triazol-1-yl]-4-(1H-pyrrol-1-yl)-1,2,5-oxadiazole
Smiles: COc1ccc(cc1)c1cnnn1c1nonc1n1cccc1

STK781398
Synonyms: 1-(2-phenylethyl)-6-(tetrahydrofuran-2-ylmethyl)-2-thioxo-2,3,5,6,7,8-hexahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Smiles: O=c1[nH]c(=S)n(c2c1CN(CN2)CC1CCCO1)CCc1ccccc1

STK781406
Synonyms: N-(2-chloropyridin-3-yl)-N'-[3-(2-methyl-1H-imidazol-1-yl)propyl]ethanediamide
Smiles: O=C(C(=O)NCCCn1ccnc1C)Nc1cccnc1Cl

STK781407
Synonyms: N-(6-methoxypyridin-3-yl)-N'-[3-(2-methyl-1H-imidazol-1-yl)propyl]ethanediamide
Smiles: COc1ccc(cn1)NC(=O)C(=O)NCCCn1ccnc1C

STK781408
Synonyms: 4-(4-bromothiophen-2-yl)-1-(dimethylamino)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Brc1csc(c1)C1CC(=O)N(C2=C1C(=O)CCC2)N(C)C

STK781422
Synonyms: 6-(2,3-dimethoxyphenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Smiles: COc1c(OC)cccc1C1CC(=O)Nc2c1c(=O)[nH]c1n2ncn1

STK781423
Synonyms: 6-(1,3-benzodioxol-5-yl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Smiles: O=C1CC(c2ccc3c(c2)OCO3)c2c(N1)n1ncnc1[nH]c2=O

STK781424
Synonyms: 6-(3-nitrophenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Smiles: O=C1CC(c2cccc(c2)[N+](=O)[O-])c2c(N1)n1ncnc1[nH]c2=O

STK781426
Synonyms: 6-(3-fluorophenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Smiles: O=C1CC(c2cccc(c2)F)c2c(N1)n1ncnc1[nH]c2=O

STK781427
Synonyms: 7-methyl-4-[4-(methylsulfanyl)phenyl]-3,4-dihydro-2H-dipyrido[1,2-a:3',2'-e]pyrimidine-2,5(1H)-dione
Smiles: CSc1ccc(cc1)C1CC(=O)Nc2c1c(=O)nc1n2cccc1C

STK781429
Synonyms: 7-methyl-4-(thiophen-3-yl)-3,4-dihydro-2H-dipyrido[1,2-a:3',2'-e]pyrimidine-2,5(1H)-dione
Smiles: O=C1CC(c2cscc2)c2c(N1)n1cccc(c1nc2=O)C

STK781433
Synonyms: 4-[4-(benzyloxy)-3-methoxyphenyl]-3,4-dihydro-2H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-2,5(1H)-dione
Smiles: COc1cc(ccc1OCc1ccccc1)C1CC(=O)Nc2c1c(=O)nc1n2ccs1

STK686189
Synonyms: 7'-amino-1-(3-fluorobenzyl)-2'-[(3-fluorobenzyl)sulfanyl]-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: N#CC1=C(N)Nc2c(C31c1ccccc1N(C3=O)Cc1cccc(c1)F)c(=O)[nH]c(n2)SCc1cccc(c1)F

STK686190
Synonyms: 7'-amino-1-(3-fluorobenzyl)-2'-[(2-fluorobenzyl)sulfanyl]-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: N#CC1=C(N)Nc2c(C31C(=O)N(c1c3cccc1)Cc1cccc(c1)F)c(=O)[nH]c(n2)SCc1ccccc1F

STK686192
Synonyms: 7'-amino-1-(2-fluorobenzyl)-2'-[(3-fluorobenzyl)sulfanyl]-2,4'-dioxo-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: N#CC1=C(N)Nc2c(C31C(=O)N(c1c3cccc1)Cc1ccccc1F)c(=O)[nH]c(n2)SCc1cccc(c1)F

STK781440
Synonyms: 5-(2-chloro-6-fluorophenyl)-1,3-dimethyl-5,8-dihydropyrido[2,3-d]pyrimidine-2,4,7(1H,3H,6H)-trione
Smiles: O=C1CC(c2c(F)cccc2Cl)c2c(N1)n(C)c(=O)n(c2=O)C

STK781443
Synonyms: 4-(2,4,5-trimethoxyphenyl)-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: COc1cc(OC)c(cc1C1CC(=O)Oc2c1c(=O)[nH]c1c2cccc1)OC

STK781447
Synonyms: 1,3-dimethyl-5-(3-methylphenyl)-6-(pyridin-2-yl)-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
Smiles: Cc1cccc(c1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1ccccn1

STK781461
Synonyms: 2-(3,4-dimethoxyphenyl)-N-[5-(4-methoxyphenyl)-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide
Smiles: COc1ccc(cc1)c1n(NC(=O)Cc2ccc(c(c2)OC)OC)cc2c1c(=O)n(c(=O)n2C)C

STK781462
Synonyms: 4-[3-(3-nitrophenyl)-1H-pyrazol-4-yl]-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: NC1=Nc2nc3c(n2C(N1)c1c[nH]nc1c1cccc(c1)[N+](=O)[O-])cccc3

STK686195
Synonyms: 4-(1-benzyl-5-methoxy-1H-indol-3-yl)-3,4-dihydro[1,3,5]triazino[1,2-a]benzimidazol-2-amine
Smiles: COc1ccc2c(c1)c(cn2Cc1ccccc1)C1NC(=Nc2n1c1ccccc1n2)N

STK781465
Synonyms: 3-[4-(1H-pyrrol-1-yl)phenyl]-N-(3,4,5-trimethoxybenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(CNC(=O)c2onc(n2)c2ccc(cc2)n2cccc2)cc(c1OC)OC

STK781466
Synonyms: 4'-(furan-2-yl)-3''-(furan-2-ylmethyl)-1,1'-dimethyl-2''-thioxo-4''H-dispiro[indole-3,2'-pyrrolidine-3',5''-[1,3]thiazolidine]-2,4''(1H)-dione
Smiles: S=C1SC2(C(=O)N1Cc1ccco1)C(CN(C12C(=O)N(c2c1cccc2)C)C)c1ccco1

STK781476
Synonyms: 1-{4-amino-2-[(4-methoxyphenyl)amino]-1,3-thiazol-5-yl}ethanone
Smiles: COc1ccc(cc1)Nc1nc(c(s1)C(=O)C)N

STK781477
Synonyms: {4-amino-2-[(4-methoxyphenyl)amino]-1,3-thiazol-5-yl}(4-chlorophenyl)methanone
Smiles: COc1ccc(cc1)Nc1nc(c(s1)C(=O)c1ccc(cc1)Cl)N

STK781478
Synonyms: 2-(3,4-dimethoxyphenyl)-7,7-dimethyl-1-(pyridin-4-yl)-2,3,7,8-tetrahydroquinoline-4,5(1H,6H)-dione
Smiles: COc1cc(ccc1OC)C1CC(=O)C2=C(N1c1ccncc1)CC(CC2=O)(C)C

STK781479
Synonyms: 1-{[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]acetyl}piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)C(=O)CSc1nnc2n1ncn2N

STK781480
Synonyms: 1'-(2-chlorobenzyl)-5-(hydroxymethyl)-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: OCC1(COC2(OC1)c1ccccc1N(C2=O)Cc1ccccc1Cl)[N+](=O)[O-]

STK781481
Synonyms: 1'-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-4,7-dihydrospiro[1,3-dioxepine-2,3'-indol]-2'(1'H)-one
Smiles: COc1ccc(cc1)N1CCN(CC1)CN1c2ccccc2C2(C1=O)OCC=CCO2

STK686200
Synonyms: 1'-[(4-benzylpiperidin-1-yl)methyl]-4,7-dihydrospiro[1,3-dioxepine-2,3'-indol]-2'(1'H)-one
Smiles: O=C1N(CN2CCC(CC2)Cc2ccccc2)c2c(C31OCC=CCO3)cccc2

STK686209
Synonyms: N-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}furan-2-carboxamide
Smiles: S=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)NC(=O)c1ccco1

STK781488
Synonyms: 2-chloro-5-[3-(pyridin-4-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]benzoicacid
Smiles: Sc1nnc(n1c1ccc(c(c1)C(=O)O)Cl)c1ccncc1

STK781490
Synonyms: 1'-[(4-phenylpiperazin-1-yl)methyl]-4,7-dihydrospiro[1,3-dioxepine-2,3'-indol]-2'(1'H)-one
Smiles: O=C1N(CN2CCN(CC2)c2ccccc2)c2c(C31OCC=CCO3)cccc2

STK781494
Synonyms: 3-amino-N-(4-chlorophenyl)-6-(propan-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b][1,6]naphthyridine-2-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)cc1c(n2)CCN(C1)C(C)C

STK686210
Synonyms: 2-[4-(methylsulfonyl)phenyl]-1,3-thiazolidine-4-carboxylicacid
Smiles: OC(=O)C1CSC(N1)c1ccc(cc1)S(=O)(=O)C

STK781495
Synonyms: N'-[(2Z)-5,5-dimethyl-3-oxo-5,6-dihydropyrrolo[2,1-a]isoquinolin-2(3H)-ylidene]pyridine-4-carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C\1/C=C2N(C1=O)C(C)(C)Cc1c2cccc1

STK781498
Synonyms: N-[3-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
Smiles: O=C(c1cccnn1)Nc1cccc(c1)C(F)(F)F

STK781499
Synonyms: N-[4-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
Smiles: O=C(c1cccnn1)Nc1ccc(cc1)C(F)(F)F

STK781500
Synonyms: N-benzylpyridazine-3-carboxamide
Smiles: O=C(c1cccnn1)NCc1ccccc1

STK781501
Synonyms: N-(3-fluorophenyl)pyridazine-3-carboxamide
Smiles: Fc1cccc(c1)NC(=O)c1cccnn1

STK781502
Synonyms: N-(4-chlorophenyl)pyridazine-3-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cccnn1

STK781504
Synonyms: N-(3-chloro-4-fluorophenyl)pyridazine-3-carboxamide
Smiles: O=C(c1cccnn1)Nc1ccc(c(c1)Cl)F

STK686211
Synonyms: 3-nitro-1-(4-nitrobenzyl)-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Smiles: [O-][N+](=O)c1ccc(cc1)Cn1nc(n2c1ncn2)[N+](=O)[O-]

STK781508
Synonyms: 2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-(2-cyanophenyl)acetamide
Smiles: N#Cc1ccccc1NC(=O)CSc1nnc2n1ncn2N

STK781511
Synonyms: N-(5-methyl-1,3-benzothiazol-2-yl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
Smiles: O=C(Nc1nc2c(s1)ccc(c2)C)Cn1cnc(n1)[N+](=O)[O-]

STK781512
Synonyms: 4-fluoro-N-[2-(trifluoromethyl)-1H-benzimidazol-7-yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1cccc2c1[nH]c(n2)C(F)(F)F

STK686212
Synonyms: 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-[4-(propan-2-yloxy)phenyl]propanoicacid
Smiles: OC(=O)CC(N1C(=O)c2c(C1=O)cccc2)c1ccc(cc1)OC(C)C

STK686213
Synonyms: 3-phenoxydibenzo[b,f][1,4]oxazepin-11(10H)-one
Smiles: O=C1Nc2ccccc2Oc2c1ccc(c2)Oc1ccccc1

STK686214
Synonyms: 1-methyl-4-oxo-N-(pyridin-2-yl)-1,4-dihydroquinoline-3-carboxamide
Smiles: O=C(c1cn(C)c2c(c1=O)cccc2)Nc1ccccn1

STK781515
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-[3-(2-methyl-1H-imidazol-1-yl)propyl]ethanediamide
Smiles: O=C(C(=O)NCCCn1ccnc1C)Nc1ccc2c(c1)OCCO2

STK781517
Synonyms: N-(3-chloro-4-fluorophenyl)-N'-[3-(2-methyl-1H-imidazol-1-yl)propyl]ethanediamide
Smiles: O=C(C(=O)NCCCn1ccnc1C)Nc1ccc(c(c1)Cl)F

STK781519
Synonyms: 2-amino-4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-methoxypyridine-3,5-dicarbonitrile
Smiles: CCn1cc(c(n1)C)c1c(C#N)c(N)nc(c1C#N)OC

STK781524
Synonyms: 6-(4-ethoxyphenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Smiles: CCOc1ccc(cc1)C1CC(=O)Nc2c1c(=O)[nH]c1n2ncn1

STK781525
Synonyms: 6-(3,4-dimethoxyphenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Smiles: COc1cc(ccc1OC)C1CC(=O)Nc2c1c(=O)[nH]c1n2ncn1

STK781527
Synonyms: 4-(4-methoxyphenyl)-7-methyl-3,4-dihydro-2H-dipyrido[1,2-a:3',2'-e]pyrimidine-2,5(1H)-dione
Smiles: COc1ccc(cc1)C1CC(=O)Nc2c1c(=O)nc1n2cccc1C

STK781528
Synonyms: 4-(4-fluorophenyl)-7-methyl-3,4-dihydro-2H-dipyrido[1,2-a:3',2'-e]pyrimidine-2,5(1H)-dione
Smiles: O=C1CC(c2ccc(cc2)F)c2c(N1)n1cccc(c1nc2=O)C

STK781538
Synonyms: ethyl5-amino-6-cyano-7-(2,5-dimethylthiophen-3-yl)-2-methyl-7H-thieno[3,2-b]pyran-3-carboxylate
Smiles: CCOC(=O)c1c(C)sc2c1OC(=C(C2c1cc(sc1C)C)C#N)N

STK781543
Synonyms: 4-(3-methoxyphenyl)-7-methyl-3,4-dihydro-2H-dipyrido[1,2-a:3',2'-e]pyrimidine-2,5(1H)-dione
Smiles: COc1cccc(c1)C1CC(=O)Nc2c1c(=O)nc1n2cccc1C

STK781544
Synonyms: 4-(1,3-benzodioxol-5-yl)-7-methyl-3,4-dihydro-2H-dipyrido[1,2-a:3',2'-e]pyrimidine-2,5(1H)-dione
Smiles: O=C1CC(c2ccc3c(c2)OCO3)c2c(N1)n1cccc(c1nc2=O)C

STK781548
Synonyms: 7'-amino-2'-[(3-fluorobenzyl)sulfanyl]-2,4'-dioxo-1-(prop-2-yn-1-yl)-1,2,4',8'-tetrahydro-3'H-spiro[indole-3,5'-pyrido[2,3-d]pyrimidine]-6'-carbonitrile
Smiles: C#CCN1c2ccccc2C2(C1=O)C(=C(N)Nc1c2c(=O)[nH]c(n1)SCc1cccc(c1)F)C#N

STK781549
Synonyms: 4-phenyl-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: O=C1CC(c2ccccc2)c2c(O1)c1ccccc1[nH]c2=O

STK781551
Synonyms: ethyl(3'-benzyl-2,4',6'-trioxo-5'-phenyl-3',3a',4',5',6',6a'-hexahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-1(2H)-yl)acetate
Smiles: CCOC(=O)CN1c2ccccc2C2(C1=O)NC(C1C2C(=O)N(C1=O)c1ccccc1)Cc1ccccc1

STK686218
Synonyms: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]methanone
Smiles: CC(=CC1C(C1(C)C)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)C

STK781553
Synonyms: 2-[(7-amino-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-3-yl)sulfanyl]-N-{4-[chloro(difluoro)methoxy]phenyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OC(Cl)(F)F)CSc1nnc2n1ncn2N

STK686219
Synonyms: 2-(2,3-dihydro-1H-inden-1-yl)-N-(4-sulfamoylbenzyl)acetamide
Smiles: O=C(CC1CCc2c1cccc2)NCc1ccc(cc1)S(=O)(=O)N

STK781555
Synonyms: [4-(4-fluorophenyl)piperazin-1-yl](4-methyl-1,3-thiazol-5-yl)methanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)c1scnc1C

STK781556
Synonyms: 4-methyl-N-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxamide
Smiles: O=C(c1scnc1C)Nc1cccc(c1)C(F)(F)F

STK781557
Synonyms: 3-[5-(4-chlorophenyl)-1H-1,2,3-triazol-1-yl]-4-(1H-pyrrol-1-yl)-1,2,5-oxadiazole
Smiles: Clc1ccc(cc1)c1cnnn1c1nonc1n1cccc1

STK686222
Synonyms: 3-[5-(4-fluorophenyl)-1H-1,2,3-triazol-1-yl]-4-(1H-pyrrol-1-yl)-1,2,5-oxadiazole
Smiles: Fc1ccc(cc1)c1cnnn1c1nonc1n1cccc1

STK781565
Synonyms: 5-amino-4-(4-methoxyphenyl)-7-(pyridin-3-yl)-2,3,4,7-tetrahydrothieno[3,2-b]pyridine-6-carbonitrile1,1-dioxide
Smiles: N#CC1=C(N)N(c2ccc(cc2)OC)C2=C(C1c1cccnc1)S(=O)(=O)CC2

STK781566
Synonyms: 5-amino-4-(4-methoxyphenyl)-7-(pyridin-4-yl)-2,3,4,7-tetrahydrothieno[3,2-b]pyridine-6-carbonitrile1,1-dioxide
Smiles: N#CC1=C(N)N(c2ccc(cc2)OC)C2=C(C1c1ccncc1)S(=O)(=O)CC2

STK781567
Synonyms: N-{4-[5-amino-6-cyano-4-(4-methoxyphenyl)-1,1-dioxido-2,3,4,7-tetrahydrothieno[3,2-b]pyridin-7-yl]phenyl}acetamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)OC)C2=C(C1c1ccc(cc1)NC(=O)C)S(=O)(=O)CC2

STK781571
Synonyms: 8-methyl-3-(1-phenylethyl)-1,2,3,4,8,9-hexahydro-5H-pyrimido[5,4-e][1,3]thiazolo[3,2-a]pyrimidin-5-one
Smiles: CC1Cn2c(S1)nc(=O)c1c2NCN(C1)C(c1ccccc1)C

STK781572
Synonyms: 1,4-bis{[2-(pyridin-2-yl)ethyl]sulfanyl}butane-2,3-diol
Smiles: OC(C(CSCCc1ccccn1)O)CSCCc1ccccn1

STK686228
Synonyms: N'-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-N'-methyltetradecanehydrazide
Smiles: CCCCCCCCCCCCCC(=O)NN(c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C

STK686229
Synonyms: N'-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-N'-methylpentanehydrazide
Smiles: CCCCC(=O)NN(c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C

STK781574
Synonyms: N'-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-N',2-dimethylpropanehydrazide
Smiles: CC(C(=O)NN(c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C)C

STK686230
Synonyms: N'-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-N'-methyloctanehydrazide
Smiles: CCCCCCCC(=O)NN(c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C

STK781575
Synonyms: 4-chloro-N'-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-N'-methylbenzohydrazide
Smiles: Clc1ccc(cc1)C(=O)NN(c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C

STK686232
Synonyms: 6-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridine-7-carbonitrile
Smiles: N#Cc1cc2N3CCC(c2nc1SCC(=O)c1ccc(cc1)Cl)CC3

STK686233
Synonyms: 2-[(7-cyano-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridin-6-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Smiles: N#Cc1cc2N3CCC(c2nc1SCC(=O)Nc1ccccc1OC)CC3

STK686234
Synonyms: 2-[(7-cyano-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridin-6-yl)sulfanyl]acetamide
Smiles: N#Cc1cc2N3CCC(c2nc1SCC(=O)N)CC3

STK686237
Synonyms: 2-[(7-cyano-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridin-6-yl)sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Smiles: N#Cc1cc2N3CCC(c2nc1SCC(=O)NCCc1ccc(c(c1)OC)OC)CC3

STK686240
Synonyms: 8-amino-3,4-dihydro-2H-1,4-ethanothieno[2,3-b][1,5]naphthyridine-7-carboxamide
Smiles: NC(=O)c1sc2c(c1N)cc1c(n2)C2CCN1CC2

STK781581
Synonyms: 3-(1H-tetrazol-1-yl)-N-[5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]propanamide
Smiles: O=C(Nc1ncc(s1)C12CC3CC(C2)CC(C1)C3)CCn1cnnn1

STK781582
Synonyms: N-(2-methoxydibenzo[b,d]furan-3-yl)-3-(1H-tetrazol-1-yl)propanamide
Smiles: COc1cc2c(cc1NC(=O)CCn1cnnn1)oc1c2cccc1

STK781583
Synonyms: 2-methyl-1-phenyl-1H-imidazol-4-amine
Smiles: Nc1cn(c(n1)C)c1ccccc1

STK781584
Synonyms: 1-(3-oxo-3,4-dihydroquinoxalin-2-yl)thiourea
Smiles: NC(=S)Nc1nc2ccccc2[nH]c1=O

STK686245
Synonyms: 7-chloro-2,1,3-benzothiadiazol-4-amine
Smiles: Nc1ccc(c2c1nsn2)Cl

STK781587
Synonyms: 3-bromo-4,6-dimethyl[1,2]thiazolo[5,4-b]pyridine
Smiles: Cc1cc(C)c2c(n1)snc2Br

STK781588
Synonyms: (1S,2S,5R)-2-(4-cyclohexyl-3-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nc(n(c1=S)C1CCCCC1)c1ccccc1

STK781589
Synonyms: N-(4-fluorophenyl)pyridazine-3-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1cccnn1

STK781590
Synonyms: N-[2-(3,4-diethoxyphenyl)ethyl]pyridazine-3-carboxamide
Smiles: CCOc1cc(CCNC(=O)c2cccnn2)ccc1OCC

STK686246
Synonyms: N-(3-methoxyphenyl)pyridazine-3-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1cccnn1

STK781592
Synonyms: N-(3,4-dichlorophenyl)pyridazine-3-carboxamide
Smiles: O=C(c1cccnn1)Nc1ccc(c(c1)Cl)Cl

STK781593
Synonyms: N-(3-chlorophenyl)pyridazine-3-carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1cccnn1

STK781598
Synonyms: (3E)-3-[3-(furan-2-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-7-methyl-1,3-dihydro-2H-indol-2-one
Smiles: S=C1S/C(=C\2/C(=O)Nc3c2cccc3C)/C(=O)N1Cc1ccco1

STK686247
Synonyms: 4-[(5E)-5-(7-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoicacid
Smiles: OC(=O)CCCN1C(=S)S/C(=C\2/C(=O)Nc3c2cccc3C)/C1=O

STK781603
Synonyms: 2-[3-nitro-5-(1H-1,2,4-triazol-3-ylsulfanyl)-1H-1,2,4-triazol-1-yl]acetamide
Smiles: NC(=O)Cn1nc(nc1Sc1n[nH]cn1)[N+](=O)[O-]

STK781609
Synonyms: (2E)-N-benzyl-2-cyano-2-[(2-oxo-2-phenylethoxy)imino]ethanamide
Smiles: N#C/C(=N\OCC(=O)c1ccccc1)/C(=O)NCc1ccccc1

STK781610
Synonyms: 3-(4-hydroxyphenyl)-2-phenyl-10H-pyridazino[6,1-b]quinazolin-10-one
Smiles: Oc1ccc(cc1)c1cc2nc3ccccc3c(=O)n2nc1c1ccccc1

STK781613
Synonyms: 1,3-dimethyl-5,5-bis(pyridin-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1N(C)C(=O)C(C(=O)N1C)(Cc1ccccn1)Cc1ccccn1

STK781617
Synonyms: 2-[5-(2-fluorophenoxy)-3-nitro-1H-1,2,4-triazol-1-yl]-1-(morpholin-4-yl)ethanone
Smiles: O=C(N1CCOCC1)Cn1nc(nc1Oc1ccccc1F)[N+](=O)[O-]

STK781618
Synonyms: 2-[5-(2-methoxyphenoxy)-3-nitro-1H-1,2,4-triazol-1-yl]-1-(morpholin-4-yl)ethanone
Smiles: COc1ccccc1Oc1nc(nn1CC(=O)N1CCOCC1)[N+](=O)[O-]

STK781619
Synonyms: 2-[5-(1H-imidazol-1-yl)-3-nitro-1H-1,2,4-triazol-1-yl]-1-(morpholin-4-yl)ethanone
Smiles: O=C(N1CCOCC1)Cn1nc(nc1n1cncc1)[N+](=O)[O-]

STK781620
Synonyms: diethyl{4-[(furan-2-ylcarbonyl)amino]benzyl}phosphonate
Smiles: CCOP(=O)(Cc1ccc(cc1)NC(=O)c1ccco1)OCC

STK781621
Synonyms: diethyl{4-[(thiophen-2-ylacetyl)amino]benzyl}phosphonate
Smiles: CCOP(=O)(Cc1ccc(cc1)NC(=O)Cc1cccs1)OCC

STK781622
Synonyms: 4-amino-N-benzyl-5-(phenylcarbonyl)-1,2-oxazole-3-carboxamide
Smiles: O=C(c1noc(c1N)C(=O)c1ccccc1)NCc1ccccc1

STK686252
Synonyms: 4-(2-oxopyrrolidin-1-yl)-N-[1-(pyrrolidin-1-ylmethyl)cyclohexyl]benzenesulfonamide
Smiles: O=C1CCCN1c1ccc(cc1)S(=O)(=O)NC1(CCCCC1)CN1CCCC1

STK781625
Synonyms: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
Smiles: COc1ccc2c(c1)c(CCNS(=O)(=O)c1ccc(cc1)N1CCCC1=O)c[nH]2

STK686253
Synonyms: 2,5-anhydro-4-deoxy-3-C-methyl-5-phenyl-2-thiopentonicacid
Smiles: OC(=O)C1SC(CC1(C)O)c1ccccc1

STK781627
Synonyms: 5-chloro-2-methoxy-4-methyl-N-(3-methylpent-1-yn-3-yl)benzenesulfonamide
Smiles: CCC(NS(=O)(=O)c1cc(Cl)c(cc1OC)C)(C#C)C

STK781629
Synonyms: 2,5-dimethoxy-N-(2-oxo-1,2-dihydropyridin-3-yl)benzenesulfonamide
Smiles: COc1ccc(c(c1)S(=O)(=O)Nc1ccc[nH]c1=O)OC

STK781631
Synonyms: 4-ethoxy-N-(thiophen-2-ylmethyl)benzenesulfonamide
Smiles: CCOc1ccc(cc1)S(=O)(=O)NCc1cccs1

STK781636
Synonyms: 2-benzyl-1-[(3,4-dichloro-2-methoxyphenyl)sulfonyl]-4,5-dihydro-1H-imidazole
Smiles: COc1c(Cl)c(Cl)ccc1S(=O)(=O)N1CCN=C1Cc1ccccc1

STK781638
Synonyms: 2-benzyl-1-[(4-chloro-2,5-dimethoxyphenyl)sulfonyl]-4,5-dihydro-1H-imidazole
Smiles: COc1cc(Cl)c(cc1S(=O)(=O)N1CCN=C1Cc1ccccc1)OC

STK781639
Synonyms: 2-benzyl-1-[(2,5-dichloro-4-methoxyphenyl)sulfonyl]-4,5-dihydro-1H-imidazole
Smiles: COc1cc(Cl)c(cc1Cl)S(=O)(=O)N1CCN=C1Cc1ccccc1

STK781640
Synonyms: 2-benzyl-1-[(4-ethoxy-3-methylphenyl)sulfonyl]-4,5-dihydro-1H-imidazole
Smiles: CCOc1ccc(cc1C)S(=O)(=O)N1CCN=C1Cc1ccccc1

STK781643
Synonyms: 1-{[(2,6-dimethylmorpholin-4-yl)sulfonyl]methyl}-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Smiles: CC1OC(C)CN(C1)S(=O)(=O)CC12CCC(C2(C)C)CC1=O

STK781644
Synonyms: 4,5-dichloro-N-(1H-indazol-6-yl)-2-methylbenzenesulfonamide
Smiles: Cc1cc(Cl)c(cc1S(=O)(=O)Nc1ccc2c(c1)[nH]nc2)Cl

STK781645
Synonyms: 1-({[4-(3-chloro-2-methylphenyl)piperazin-1-yl]sulfonyl}methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Smiles: O=C1CC2C(C1(CC2)CS(=O)(=O)N1CCN(CC1)c1cccc(c1C)Cl)(C)C

STK781647
Synonyms: 2-benzyl-1-[(3-ethoxy-4-fluorophenyl)sulfonyl]-4,5-dihydro-1H-imidazole
Smiles: CCOc1cc(ccc1F)S(=O)(=O)N1CCN=C1Cc1ccccc1

STK686258
Synonyms: 2-butanoyl-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione
Smiles: CCCC(=O)C1C(=O)CC(CC1=O)c1ccc(c(c1)OC)OC

STK781653
Synonyms: 1-(3-methoxyphenyl)-3-[2-(pyridin-4-yl)ethyl]urea
Smiles: COc1cccc(c1)NC(=O)NCCc1ccncc1

STK781654
Synonyms: N~1~-(4-fluorophenyl)piperidine-1,3-dicarboxamide
Smiles: NC(=O)C1CCCN(C1)C(=O)Nc1ccc(cc1)F

STK781655
Synonyms: N~1~-[3-(trifluoromethyl)phenyl]piperidine-1,3-dicarboxamide
Smiles: NC(=O)C1CCCN(C1)C(=O)Nc1cccc(c1)C(F)(F)F

STK781658
Synonyms: 1-(2,1,3-benzothiadiazol-4-yl)-3-(4-chlorophenyl)urea
Smiles: O=C(Nc1cccc2c1nsn2)Nc1ccc(cc1)Cl

STK781659
Synonyms: ethyl5-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(O)cc2)CC(=O)OC

STK781660
Synonyms: ethyl5-methoxy-1-(2-methoxy-2-oxoethyl)-2-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c2cc(OC)ccc2n(c1C)CC(=O)OC

STK781661
Synonyms: 6-amino-2-oxo-3-(prop-2-en-1-yl)-3,4-dihydro-2H-1,3,4-oxadiazine-5-carbonitrile
Smiles: Nc1oc(=O)n([nH]c1C#N)CC=C

STK781662
Synonyms: N-(3,5-dichlorophenyl)-N'-[3-(2-methyl-1H-imidazol-1-yl)propyl]ethanediamide
Smiles: Clc1cc(cc(c1)Cl)NC(=O)C(=O)NCCCn1ccnc1C

STK686262
Synonyms: 8-ethyl-5-oxo-2-(piperazin-1-yl)-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCNCC1

STK781663
Synonyms: 3-acetyl-1-[2-(1H-benzimidazol-2-yl)ethyl]-2,6-dimethylpyridin-4(1H)-one
Smiles: CC(=O)c1c(=O)cc(n(c1C)CCc1nc2c([nH]1)cccc2)C

STK686263
Synonyms: ethyl6-hydroxy-7,9-dimethyl-2-(trifluoromethyl)-6H-2,6-methano[1,3,5]trioxocino[6,7-b]pyridine-4-carboxylate
Smiles: CCOC(=O)C1OC2(O)CC(O1)(Oc1c2c(C)cc(n1)C)C(F)(F)F

STK781664
Synonyms: 6-(trifluoromethyl)bis[1,2,4]triazolo[4,3-a:3',4'-c]quinoxaline
Smiles: FC(c1ccc2c(c1)n1cnnc1c1n2cnn1)(F)F

STK781665
Synonyms: ethyl1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(benzylsulfanyl)methyl]-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1CSCc1ccccc1)c1nonc1N

STK686264
Synonyms: 5-(4-fluorophenyl)-3-(pyridin-3-yl)-5-(trifluoromethyl)imidazolidine-2,4-dione
Smiles: Fc1ccc(cc1)C1(NC(=O)N(C1=O)c1cccnc1)C(F)(F)F

STK781667
Synonyms: 1-(2,3-dimethylphenyl)-4-(2-methoxyphenyl)-3-(thiophen-2-yl)piperazine-2,5-dione
Smiles: COc1ccccc1N1C(=O)CN(C(=O)C1c1cccs1)c1cccc(c1C)C

STK781672
Synonyms: [4-amino-2-(benzylamino)-1,3-thiazol-5-yl](4-fluorophenyl)methanone
Smiles: Fc1ccc(cc1)C(=O)c1sc(nc1N)NCc1ccccc1

STK781673
Synonyms: 4-amino-5-[(3,4-dimethoxyphenyl)carbonyl]-2-(methylamino)thiophene-3-carbonitrile
Smiles: COc1cc(ccc1OC)C(=O)c1sc(c(c1N)C#N)NC

STK686269
Synonyms: 2-[(1H-benzotriazol-4-ylamino)methyl]-4,6-dichlorophenol
Smiles: Clc1cc(CNc2cccc3c2nn[nH]3)c(c(c1)Cl)O

STK781675
Synonyms: 5-{[4-(benzyloxy)-2-hydroxybenzyl]amino}-1H-pyrazole-4-carbonitrile
Smiles: N#Cc1cn[nH]c1NCc1ccc(cc1O)OCc1ccccc1

STK781677
Synonyms: N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)Br)[N+](=O)[O-])NCCc1nc2c([nH]1)cccc2

STK686270
Synonyms: 1,1'-methanediylbis{3-[2-(morpholin-4-yl)ethyl]-1,2,3,4-tetrahydro[1,3,5]triazino[1,2-a]benzimidazole}
Smiles: O1CCN(CC1)CCN1CN(CN2CN(CCN3CCOCC3)Cn3c2nc2c3cccc2)c2n(C1)c1ccccc1n2

STK781680
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-2-methylfuran-3-carboxamide
Smiles: O=C(c1ccoc1C)NCc1nc2c([nH]1)cccc2

STK781683
Synonyms: 4-(3,4,5-trimethoxyphenyl)-4,6-dihydro-2H-pyrano[3,2-c]quinoline-2,5(3H)-dione
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)Oc2c1c(=O)[nH]c1c2cccc1

STK686271
Synonyms: 3-(2,5-dioxopyrrolidin-1-yl)-3-(4-methoxyphenyl)propanoicacid
Smiles: COc1ccc(cc1)C(N1C(=O)CCC1=O)CC(=O)O

STK781685
Synonyms: 1,1-bis(acetylamino)-1-deoxy-D-galactitol
Smiles: OCC(C(C(C(C(NC(=O)C)NC(=O)C)O)O)O)O

STK781686
Synonyms: [4-amino-2-(benzylamino)-1,3-thiazol-5-yl](4-chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)c1sc(nc1N)NCc1ccccc1

STK686275
Synonyms: 2-[(7-cyano-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridin-6-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
Smiles: N#Cc1cc2N3CCC(c2nc1SCC(=O)Nc1ccc(cc1)C(F)(F)F)CC3

STK781690
Synonyms: 8-amino-N-(3,4-difluorophenyl)-3,4-dihydro-2H-1,4-ethanothieno[2,3-b][1,5]naphthyridine-7-carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)C2CCN1CC2)Nc1ccc(c(c1)F)F

STK686277
Synonyms: N-[2-(4-chlorophenyl)ethyl]-2-[(7-cyano-3,4-dihydro-2H-1,4-ethano-1,5-naphthyridin-6-yl)sulfanyl]acetamide
Smiles: N#Cc1cc2N3CCC(c2nc1SCC(=O)NCCc1ccc(cc1)Cl)CC3

STK686279
Synonyms: ethyl4-{[(8-amino-3,4-dihydro-2H-1,4-ethanothieno[2,3-b][1,5]naphthyridin-7-yl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1sc2c(c1N)cc1c(n2)C2CCN1CC2

STK781693
Synonyms: 3-(butylsulfanyl)-1-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Smiles: CCCCSc1cc2Oc3ccccc3NC(=O)c2c(c1)[N+](=O)[O-]

STK686283
Synonyms: 1-benzyloctahydro-1'H-spiro[piperidine-4,5'-pyrano[3,4-a]pyrrolizin]-1'-one
Smiles: O=C1OCCC2C1C1CCCN1C12CCN(CC1)Cc1ccccc1

STK781695
Synonyms: 2-(4-fluorophenyl)-8-methylimidazo[1,2-a]pyridin-3-amine
Smiles: Fc1ccc(cc1)c1nc2n(c1N)cccc2C

STK686284
Synonyms: methyl1-benzylhexahydrospiro[piperidine-4,3'-pyrrolizine]-1'-carboxylate
Smiles: COC(=O)C1CC2(N3C1CCC3)CCN(CC2)Cc1ccccc1

STK781696
Synonyms: N-benzyl-2-(4-fluorophenyl)imidazo[1,2-a]pyrazin-3-amine
Smiles: Fc1ccc(cc1)c1nc2n(c1NCc1ccccc1)ccnc2

STK781697
Synonyms: 2-(4-fluorophenyl)-7-methyl-N-(2,4,4-trimethylpentan-2-yl)imidazo[1,2-a]pyridin-3-amine
Smiles: Cc1ccn2c(c1)nc(c2NC(CC(C)(C)C)(C)C)c1ccc(cc1)F

STK686285
Synonyms: 2-(4-fluorophenyl)-5-propylimidazo[1,2-a]pyridin-3-amine
Smiles: CCCc1cccc2n1c(N)c(n2)c1ccc(cc1)F

STK781699
Synonyms: 8-(benzyloxy)-2-(4-fluorophenyl)-N-(2,4,4-trimethylpentan-2-yl)imidazo[1,2-a]pyridin-3-amine
Smiles: Fc1ccc(cc1)c1nc2n(c1NC(CC(C)(C)C)(C)C)cccc2OCc1ccccc1

STK686286
Synonyms: 9H-fluoren-9-ylmethyl{1-oxo-1-[(6-oxo-1,6-dihydro-3,4'-bipyridin-5-yl)amino]-3-(pyridin-3-yl)propan-2-yl}carbamate
Smiles: O=C(NC(C(=O)Nc1cc(c[nH]c1=O)c1ccncc1)Cc1cccnc1)OCC1c2ccccc2c2c1cccc2

STK781701
Synonyms: 6-bromo-4-fluoro-3-(thiophen-2-yl)quinolin-2(1H)-one
Smiles: Brc1ccc2c(c1)c(F)c(c(=O)[nH]2)c1cccs1

STK686288
Synonyms: tert-butyl(2R,4S)-4-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-2-[(6-oxo-1,6-dihydro-3,4'-bipyridin-5-yl)carbamoyl]pyrrolidine-1-carboxylate
Smiles: O=C(N[C@H]1C[C@@H](N(C1)C(=O)OC(C)(C)C)C(=O)Nc1cc(c[nH]c1=O)c1ccncc1)OCC1c2ccccc2c2c1cccc2

STK781702
Synonyms: 3-[2-(1,3-dioxan-2-yl)ethyl]-3-hydroxy-1,3-dihydro-2H-indol-2-one
Smiles: O=C1Nc2c(C1(O)CCC1OCCCO1)cccc2

STK686289
Synonyms: methyl3-amino-3-(2-fluorophenyl)propanoate
Smiles: COC(=O)CC(c1ccccc1F)N

STK781704
Synonyms: 2,2,2-trifluoro-N-{4-[(1-phenyl-1H-pyrazol-5-yl)sulfamoyl]phenyl}acetamide
Smiles: O=C(C(F)(F)F)Nc1ccc(cc1)S(=O)(=O)Nc1ccnn1c1ccccc1

STK686295
Synonyms: 1-(5-methyl-1,3,4-thiadiazol-2-yl)-3-[3-(trifluoromethyl)phenyl]urea
Smiles: O=C(Nc1nnc(s1)C)Nc1cccc(c1)C(F)(F)F

STK686297
Synonyms: 5-methyl-N-[4-(morpholin-4-yl)phenyl]-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Smiles: O=C(c1nn(nc1C)c1ccccc1)Nc1ccc(cc1)N1CCOCC1

STK686301
Synonyms: 3-chloro-6-(3,4-difluorophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-1-carboxylicacid
Smiles: Clc1cc2NC(c3ccc(c(c3)F)F)C3C(c2c(c1)C(=O)O)C1CCC3C1

STK686302
Synonyms: 6-(3,5-dichlorophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylicacid
Smiles: Clc1cc(Cl)cc(c1)C1Nc2c(cccc2C2C1C1CCC2C1)C(=O)O

STK686303
Synonyms: 6-(2,4-difluorophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylicacid
Smiles: Fc1ccc(c(c1)F)C1Nc2c(C3C1C1CCC3C1)cccc2C(=O)O

STK686304
Synonyms: 3-{2-[2-(pyridin-2-ylamino)ethyl]-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-6-yl}benzoicacid
Smiles: OC(=O)c1cccc(c1)C1Nc2ccc(cc2C2C1C1CCC2C1)CCNc1ccccn1

STK686305
Synonyms: 3-{2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfamoyl]-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-6-yl}benzoicacid
Smiles: OC(=O)c1cccc(c1)C1Nc2ccc(cc2C2C1C1CCC2C1)S(=O)(=O)Nc1oc(c(n1)C)C

STK686307
Synonyms: {4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl}aceticacid
Smiles: COC(=O)c1ccc(cc1)C1Nc2ccc(cc2C2C1CC=C2)CC(=O)O

STK686308
Synonyms: 3-{2-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-6-yl}benzoicacid
Smiles: Cc1onc(c1)NS(=O)(=O)c1ccc2c(c1)C1C3CCC(C1C(N2)c1cccc(c1)C(=O)O)C3

STK686309
Synonyms: 3-[8-(pyrimidin-2-ylsulfamoyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]benzoicacid
Smiles: OC(=O)c1cccc(c1)C1Nc2ccc(cc2C2C1CC=C2)S(=O)(=O)Nc1ncccn1

STK686317
Synonyms: 2,4-difluoro-N-{2-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl}benzamide
Smiles: COc1cccc(c1)c1nnc(o1)c1ccccc1NC(=O)c1ccc(cc1F)F

STK781716
Synonyms: N-{2-[5-(2-bromo-5-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl}pyridine-4-carboxamide
Smiles: COc1ccc(c(c1)c1nnc(o1)c1ccccc1NC(=O)c1ccncc1)Br

STK686323
Synonyms: 3-cyclopentyl-N-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}propanamide
Smiles: O=C(Nc1ccccc1c1nnc(o1)c1ccc(c(c1)Cl)Cl)CCC1CCCC1

STK686327
Synonyms: N-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}-2-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)Nc1ccccc1c1nnc(o1)c1ccc(c(c1)Cl)Cl

STK686329
Synonyms: N-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}-2-phenylcyclopropanecarboxamide
Smiles: O=C(C1CC1c1ccccc1)Nc1ccccc1c1nnc(o1)c1ccc(c(c1)Cl)Cl

STK686330
Synonyms: N-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}-2-(3,4-dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)CC(=O)Nc1ccccc1c1nnc(o1)c1ccc(c(c1)Cl)Cl

STK686331
Synonyms: methyl3-({2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}amino)-3-oxopropanoate
Smiles: COC(=O)CC(=O)Nc1ccccc1c1nnc(o1)c1ccc(c(c1)Cl)Cl

STK686333
Synonyms: N-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}-2-methoxyacetamide
Smiles: COCC(=O)Nc1ccccc1c1nnc(o1)c1ccc(c(c1)Cl)Cl

STK686335
Synonyms: 2-chloro-5-(1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)benzenesulfonamide
Smiles: O=C1NC(c2c1cccc2)(O)c1ccc(c(c1)S(=O)(=O)N)Cl

STK686336
Synonyms: 3-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]-2-phenoxypyridine
Smiles: Clc1ccc(cc1Cl)c1nnc(o1)c1cccnc1Oc1ccccc1

STK686340
Synonyms: 6-(3,4-difluorophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylicacid
Smiles: OC(=O)c1cccc2c1NC(c1ccc(c(c1)F)F)C1C2C2CCC1C2

STK686341
Synonyms: 2-chloro-6-[3-(trifluoromethyl)phenyl]-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylicacid
Smiles: Clc1cc(C(=O)O)c2c(c1)C1C3CCC(C1C(N2)c1cccc(c1)C(F)(F)F)C3

STK686342
Synonyms: 2-chloro-6-(pentan-3-yl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylicacid
Smiles: CCC(C1Nc2c(C3C1C1CCC3C1)cc(cc2C(=O)O)Cl)CC

STK686344
Synonyms: 3-[2-(pyrimidin-2-ylsulfamoyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-6-yl]benzoicacid
Smiles: OC(=O)c1cccc(c1)C1Nc2ccc(cc2C2C1C1CCC2C1)S(=O)(=O)Nc1ncccn1

STK686345
Synonyms: 3-[2-(1,3-thiazol-2-ylsulfamoyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-6-yl]benzoicacid
Smiles: OC(=O)c1cccc(c1)C1Nc2ccc(cc2C2C1C1CCC2C1)S(=O)(=O)Nc1nccs1

STK686346
Synonyms: 1-[1-(4-tert-butylphenyl)-4-methylcyclohexyl]-4-phenylpiperazine
Smiles: CC1CCC(CC1)(N1CCN(CC1)c1ccccc1)c1ccc(cc1)C(C)(C)C

STK686348
Synonyms: 8-benzyl-6-(phenylsulfonyl)-8-azabicyclo[3.2.1]oct-3-en-2-one
Smiles: O=C1C=CC2N(C1CC2S(=O)(=O)c1ccccc1)Cc1ccccc1

STK686349
Synonyms: 9-(4-tert-butylbenzyl)-2-phenyl-3a,4,8,8a-tetrahydro-4,8-epiminocyclohepta[c]pyrrole-1,3,5(2H)-trione
Smiles: O=C1C=CC2N(C1C1C(=O)N(C(=O)C21)c1ccccc1)Cc1ccc(cc1)C(C)(C)C

STK686351
Synonyms: 4-(diphenylmethyl)-2-phenylhexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
Smiles: O=C1C2C3CCCN3C(C2C(=O)N1c1ccccc1)C(c1ccccc1)c1ccccc1

STK686352
Synonyms: N-(6-oxo-1,6-dihydro-3,4'-bipyridin-5-yl)-4-(trifluoromethoxy)benzenesulfonamide
Smiles: O=c1[nH]cc(cc1NS(=O)(=O)c1ccc(cc1)OC(F)(F)F)c1ccncc1

STK781719
Synonyms: 4-methyl-N-(6-oxo-1,6-dihydro-3,4'-bipyridin-5-yl)benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)Nc1cc(c[nH]c1=O)c1ccncc1

STK686354
Synonyms: 4-iodo-N-(6-oxo-1,6-dihydro-3,4'-bipyridin-5-yl)benzenesulfonamide
Smiles: Ic1ccc(cc1)S(=O)(=O)Nc1cc(c[nH]c1=O)c1ccncc1

STK781720
Synonyms: 7-bromo-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
Smiles: O=C1Nc2ccc(cc2C(=O)N2C1CCC2)Br

STK686356
Synonyms: 7-bromo-4-methyl-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
Smiles: O=C1CN(C)C(=O)c2c(N1)ccc(c2)Br

STK781721
Synonyms: 3-hydroxy-3-(3-methoxyphenyl)-1,3-dihydro-2H-indol-2-one
Smiles: COc1cccc(c1)C1(O)C(=O)Nc2c1cccc2

STK686358
Synonyms: 3-hydroxy-3-(2-methoxyphenyl)-1,3-dihydro-2H-indol-2-one
Smiles: COc1ccccc1C1(O)C(=O)Nc2c1cccc2

STK686361
Synonyms: 3-(3,4-dichlorophenyl)-3-hydroxy-1,3-dihydro-2H-indol-2-one
Smiles: O=C1Nc2c(C1(O)c1ccc(c(c1)Cl)Cl)cccc2

STK686362
Synonyms: 3-hydroxy-3-(4-methoxyphenyl)-1,3-dihydro-2H-indol-2-one
Smiles: COc1ccc(cc1)C1(O)C(=O)Nc2c1cccc2

STK781724
Synonyms: 5-benzyl-1-(3-methoxyphenyl)-1,4,5,7-tetrahydro[1,4]oxazocino[6,7-b]indol-6(3H)-one
Smiles: COc1cccc(c1)C1OCCN(C(=O)c2c1c1ccccc1[nH]2)Cc1ccccc1

STK686363
Synonyms: benzyl1,3-dioxo-2-phenyl-4-(quinolin-2-yl)octahydropyrrolo[3,4-a]pyrrolizine-8a(6H)-carboxylate
Smiles: O=C1N(c2ccccc2)C(=O)C2C1C(c1ccc3c(n1)cccc3)N1C2(CCC1)C(=O)OCc1ccccc1

STK686364
Synonyms: benzyl4-(3-methoxyphenyl)-1,3-dioxo-2-phenyloctahydropyrrolo[3,4-a]pyrrolizine-8a(6H)-carboxylate
Smiles: COc1cccc(c1)C1C2C(=O)N(C(=O)C2C2(N1CCC2)C(=O)OCc1ccccc1)c1ccccc1

STK686365
Synonyms: 4-[4-(methylsulfanyl)phenyl]-2-phenylhexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione
Smiles: CSc1ccc(cc1)C1N2CCCC2C2C1C(=O)N(C2=O)c1ccccc1

STK686366
Synonyms: 2-amino-4-fluoro-3-phenylnaphthalene-1-carbonitrile
Smiles: N#Cc1c(N)c(c2ccccc2)c(c2c1cccc2)F

STK686367
Synonyms: 3-benzyl-5-bromo-3-hydroxy-1,3-dihydro-2H-indol-2-one
Smiles: Brc1ccc2c(c1)C(O)(Cc1ccccc1)C(=O)N2

STK781725
Synonyms: 3'-[2-(1H-indol-3-yl)ethyl]-5'-methyl-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: CC1SC2(N(C1=O)CCc1c[nH]c3c1cccc3)C(=O)Nc1c2cccc1

STK686368
Synonyms: 4-oxo-4-[(6-oxo-1,6-dihydro-3,4'-bipyridin-5-yl)amino]butanoicacid
Smiles: O=C(Nc1cc(c[nH]c1=O)c1ccncc1)CCC(=O)O

STK686370
Synonyms: N-(8-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepin-2-yl)acetamide
Smiles: CC(=O)Nc1ccc2c(c1)C(=O)Nc1c(O2)ccc(c1)C

STK686371
Synonyms: 4-(3,4-dichlorophenyl)-6-(4-fluorophenyl)-2-(pyridin-2-yl)pyrimidine
Smiles: Fc1ccc(cc1)c1cc(nc(n1)c1ccccn1)c1ccc(c(c1)Cl)Cl

STK686376
Synonyms: 4-(3-fluorophenyl)-6-(4-fluorophenyl)-2-(pyridin-4-yl)pyrimidine
Smiles: Fc1ccc(cc1)c1cc(nc(n1)c1ccncc1)c1cccc(c1)F

STK686377
Synonyms: 4-(3,4-dichlorophenyl)-6-(3-fluorophenyl)-2-(pyridin-4-yl)pyrimidine
Smiles: Fc1cccc(c1)c1cc(nc(n1)c1ccncc1)c1ccc(c(c1)Cl)Cl

STK781729
Synonyms: 4-(4-fluorophenyl)-6-(4-methoxyphenyl)-2-(pyridin-4-yl)pyrimidine
Smiles: COc1ccc(cc1)c1cc(nc(n1)c1ccncc1)c1ccc(cc1)F

STK781732
Synonyms: ethyl5-{3-[(benzylcarbamoyl)amino]phenyl}-2-methylfuran-3-carboxylate
Smiles: CCOC(=O)c1cc(oc1C)c1cccc(c1)NC(=O)NCc1ccccc1

STK781733
Synonyms: 2-bromo-7,8,9,10-tetrahydropyrido[2,1-c][1,4]benzodiazepine-6,12(5H,6aH)-dione
Smiles: O=C1Nc2ccc(cc2C(=O)N2C1CCCC2)Br

STK686379
Synonyms: 6-(2,5-dimethylphenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylicacid
Smiles: Cc1ccc(c(c1)C1Nc2c(cccc2C2C1C1CCC2C1)C(=O)O)C

STK686381
Synonyms: 6-(2,3-difluorophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylicacid
Smiles: Fc1cccc(c1F)C1Nc2c(cccc2C2C1C1CCC2C1)C(=O)O

STK686382
Synonyms: 5-chloro-1-phenyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-amine
Smiles: Clc1cccc2c1c(N)c1c(n2)N(CC1)c1ccccc1

STK686383
Synonyms: 1,7-diphenyl-1,5,6,7-tetrahydropyrazolo[3,4-b]pyrrolo[3,2-e]pyridin-4-amine
Smiles: Nc1c2CCN(c2nc2c1cnn2c1ccccc1)c1ccccc1

STK686384
Synonyms: 5-fluoro-1-phenyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-amine
Smiles: Fc1cccc2c1c(N)c1c(n2)N(CC1)c1ccccc1

STK686386
Synonyms: 2-benzyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-amine
Smiles: Nc1c2CN(CCc2nc2c1cccc2)Cc1ccccc1

STK686389
Synonyms: 6-bromo-2-(3,4-dichlorophenyl)-4-(3,4-dimethoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-8-carboxylicacid
Smiles: COc1ccc(cc1OC)C1C(C)C(Nc2c1cc(Br)cc2C(=O)O)c1ccc(c(c1)Cl)Cl

STK686392
Synonyms: 6-bromo-4-(2,5-dimethylphenyl)-2-(1-phenylethyl)-1,2,3,4-tetrahydroquinoline-8-carboxylicacid
Smiles: Cc1ccc(c(c1)C1CC(Nc2c1cc(Br)cc2C(=O)O)C(c1ccccc1)C)C

STK686393
Synonyms: 2-(biphenyl-4-yl)-6-bromo-4-(2,5-dimethylphenyl)-1,2,3,4-tetrahydroquinoline-8-carboxylicacid
Smiles: Cc1ccc(c(c1)C1CC(Nc2c1cc(Br)cc2C(=O)O)c1ccc(cc1)c1ccccc1)C

STK686394
Synonyms: 6-bromo-2-(3,4-dichlorophenyl)-4-(2,5-dimethylphenyl)-1,2,3,4-tetrahydroquinoline-8-carboxylicacid
Smiles: Cc1ccc(c(c1)C1CC(Nc2c1cc(Br)cc2C(=O)O)c1ccc(c(c1)Cl)Cl)C

STK686396
Synonyms: 6-bromo-4-(3,4-dimethoxyphenyl)-2-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxylicacid
Smiles: COc1cc(ccc1OC)C1CC(Nc2c1cc(Br)cc2C(=O)O)c1ccc(cc1)C(C)C

STK686398
Synonyms: N-{[4-(3-methylphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]carbonyl}-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1cccc(c1)C

STK686399
Synonyms: N-({4-[3,5-bis(trifluoromethyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl}carbonyl)-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1cc(cc(c1)C(F)(F)F)C(F)(F)F

STK686400
Synonyms: N-({4-[4-(propan-2-yl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl}carbonyl)-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)C(C)C

STK686401
Synonyms: N-({4-[4-(trifluoromethyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl}carbonyl)-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)C(F)(F)F

STK686402
Synonyms: N-{[4-(3-bromophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]carbonyl}-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1cccc(c1)Br

STK686403
Synonyms: N-{[4-(pyridin-2-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]carbonyl}-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccccn1

STK686404
Synonyms: N-({4-[3-(trifluoromethyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl}carbonyl)-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1cccc(c1)C(F)(F)F

STK686405
Synonyms: N-{[4-(3-fluorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]carbonyl}-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1cccc(c1)F

STK686406
Synonyms: N-({4-[4-(methoxycarbonyl)phenyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl}carbonyl)-beta-alanine
Smiles: COC(=O)c1ccc(cc1)C1Nc2ccc(cc2C2C1CC=C2)C(=O)NCCC(=O)O

STK686408
Synonyms: N-{[4-(1,3-benzodioxol-5-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]carbonyl}-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc2c(c1)OCO2

STK686409
Synonyms: 4-(4-carboxyphenyl)-6-methoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylicacid
Smiles: COc1cc(cc2c1NC(c1ccc(cc1)C(=O)O)C1C2C=CC1)C(=O)O

STK781734
Synonyms: 5-benzyl-1-(3-chlorophenyl)-1,4,5,7-tetrahydro[1,4]oxazocino[6,7-b]indol-6(3H)-one
Smiles: Clc1cccc(c1)C1OCCN(C(=O)c2c1c1ccccc1[nH]2)Cc1ccccc1

STK686413
Synonyms: 4-(8-methoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl)benzonitrile
Smiles: COc1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)C#N

STK686414
Synonyms: N-{[4-(diphenylmethyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-8-yl]carbonyl}-beta-alanine
Smiles: OC(=O)CCNC(=O)c1ccc2c(c1)C1C=CCC1C(N2)C(c1ccccc1)c1ccccc1

STK686415
Synonyms: 4-(3,4,4a,5,6,10b-hexahydro-2H-pyrano[3,2-c]quinolin-5-yl)benzonitrile
Smiles: N#Cc1ccc(cc1)C1Nc2ccccc2C2C1CCCO2

STK686418
Synonyms: 4-{8-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl}benzoicacid
Smiles: Cc1cc(C)nc(n1)NS(=O)(=O)c1ccc2c(c1)C1C=CCC1C(N2)c1ccc(cc1)C(=O)O

STK686420
Synonyms: 2-chloro-6-(2,5-dimethylphenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridine-4-carboxylicacid
Smiles: Clc1cc2c(c(c1)C(=O)O)NC(C1C2C2CCC1C2)c1cc(C)ccc1C

STK686421
Synonyms: N-{2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}pyridine-4-carboxamide
Smiles: O=C(c1ccncc1)Nc1ccccc1c1nnc(o1)c1ccc(c(c1)Cl)Cl

STK686426
Synonyms: N-[6-(4-cyanophenyl)-5,6,6a,7,8,9,10,10a-octahydro-7,10-methanophenanthridin-2-yl]acetamide
Smiles: N#Cc1ccc(cc1)C1Nc2ccc(cc2C2C1C1CCC2C1)NC(=O)C

STK686429
Synonyms: 6-fluoro-2-(naphthalen-2-yl)quinoline-4-carboxylicacid
Smiles: Fc1ccc2c(c1)c(cc(n2)c1ccc2c(c1)cccc2)C(=O)O

STK686430
Synonyms: 6-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
Smiles: Nc1c2CCCCC(c2nc2c1cccc2)c1ccccc1

STK686431
Synonyms: N-cyclohexyl-9-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-8,11-dioxo-2-oxa-9,12-diazatricyclo[13.3.1.1~3,7~]icosa-1(19),3(20),4,6,15,17-hexaene-13-carboxamide
Smiles: COc1ccc(cc1OC)CCN1CC(=O)NC(Cc2cccc(Oc3cc(C1=O)ccc3[N+](=O)[O-])c2)C(=O)NC1CCCCC1

STK686434
Synonyms: methyl4-({2-[5-(3,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]phenyl}amino)-4-oxobutanoate
Smiles: COC(=O)CCC(=O)Nc1ccccc1c1nnc(o1)c1ccc(c(c1)Cl)Cl

STK686435
Synonyms: (3-methoxyphenyl)(dipyridin-2-yl)methanol
Smiles: COc1cccc(c1)C(c1ccccn1)(c1ccccn1)O

STK781736
Synonyms: N-[(2,4-difluorophenyl)carbonyl]-2,4-difluoro-N-[7-(thiophen-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzamide
Smiles: Fc1ccc(c(c1)F)C(=O)N(C(=O)c1ccc(cc1F)F)c1nn2c(n1)nccc2c1cccs1

STK781737
Synonyms: 2,2,2-trifluoro-N-(3-phenyl-1H-pyrazol-5-yl)acetamide
Smiles: O=C(C(F)(F)F)Nc1[nH]nc(c1)c1ccccc1

STK686437
Synonyms: 9-(4-bromobenzyl)-2-methyl-3a,4,8,8a-tetrahydro-4,8-epiminocyclohepta[c]pyrrole-1,3,5(2H)-trione
Smiles: Brc1ccc(cc1)CN1C2C=CC(=O)C1C1C2C(=O)N(C1=O)C

STK686440
Synonyms: 2-(3,5-dichlorophenyl)-4-(3,4-difluorophenyl)-6-(4-fluorophenyl)-1,3,5-triazine
Smiles: Fc1ccc(cc1)c1nc(nc(n1)c1cc(Cl)cc(c1)Cl)c1ccc(c(c1)F)F

STK686441
Synonyms: 3-[(4-iodophenyl)amino]tetrahydro-4H-furo[2,3-b]pyran-2(3H)-one
Smiles: O=C1OC2C(C1Nc1ccc(cc1)I)CCCO2

STK686442
Synonyms: 5-iodo-2-[(5-methyl-2-oxo-5-phenyltetrahydrofuran-3-yl)amino]benzoicacid(non-preferredname)
Smiles: O=C1OC(CC1Nc1ccc(cc1C(=O)O)I)(C)c1ccccc1

STK686443
Synonyms: 5-iodo-2-[(2-oxo-4,5-diphenyltetrahydrofuran-3-yl)amino]benzoicacid
Smiles: Ic1ccc(c(c1)C(=O)O)NC1C(=O)OC(C1c1ccccc1)c1ccccc1

STK686445
Synonyms: 4-(8-chloro-4-methyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinolin-4-yl)benzonitrile
Smiles: N#Cc1ccc(cc1)C1(C)Nc2ccc(cc2C2C1CCO2)Cl

STK686446
Synonyms: N-[4-(4-cyanophenyl)-4-methyl-2,3,3a,4,5,9b-hexahydrofuro[3,2-c]quinolin-8-yl]acetamide
Smiles: N#Cc1ccc(cc1)C1(C)Nc2ccc(cc2C2C1CCO2)NC(=O)C

STK781740
Synonyms: 4-(4-oxo-1,2,3,4-tetrahydroquinazolin-2-yl)benzonitrile
Smiles: N#Cc1ccc(cc1)C1NC(=O)c2c(N1)cccc2

STK686448
Synonyms: N-(4-chlorophenyl)-5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-amine
Smiles: COc1cccc(c1)c1nnc(o1)Nc1ccc(cc1)Cl

STK781742
Synonyms: 4-methoxy-5,6-dihydrobenzo[c]acridine-7-carboxylicacid
Smiles: COc1cccc2c1CCc1c2nc2c(c1C(=O)O)cccc2

STK781743
Synonyms: 4-methyl-N-[3-(4-methylpyrimidin-2-yl)phenyl]benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1cccc(c1)c1nccc(n1)C

STK686454
Synonyms: 1-phenyl-3-pyridin-3-ylthiourea
Smiles: S=C(Nc1cccnc1)Nc1ccccc1

STK686458
Synonyms: N-[(2-amino-5-bromophenyl)carbonyl]-3-cyclohexylalanine
Smiles: Brc1ccc(c(c1)C(=O)NC(C(=O)O)CC1CCCCC1)N

STK686461
Synonyms: 5-methyl-N-[3-(morpholin-4-yl)propyl]-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Smiles: O=C(c1nn(nc1C)c1ccccc1)NCCCN1CCOCC1

STK686462
Synonyms: 4-methoxy-N-(3-phenyl-1H-pyrazol-5-yl)benzamide
Smiles: COc1ccc(cc1)C(=O)Nc1[nH]nc(c1)c1ccccc1

STK781760
Synonyms: ethyl4-methyl-2-({[(6-oxo-4-propyl-1,6-dihydropyrimidin-2-yl)sulfanyl]acetyl}amino)-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)NC(=O)CSc1nc(CCC)cc(=O)[nH]1

STK686473
Synonyms: (3Z)-3-[(3-chloro-4-methylphenyl)imino]-1-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-1,3-dihydro-2H-indol-2-one
Smiles: O=C1/C(=N\c2ccc(c(c2)Cl)C)/c2c(N1CN1CCC3(CC1)OCCO3)cccc2

STK781763
Synonyms: phenyl{4-[(1-phenyl-1H-tetrazol-5-yl)oxy]phenyl}methanone
Smiles: O=C(c1ccccc1)c1ccc(cc1)Oc1nnnn1c1ccccc1

STK686492
Synonyms: 2-[(4-chlorophenyl)carbonyl]-1-cyano-2-methyl-N-(3-methylphenyl)-3-phenylcyclopropanecarboxamide
Smiles: N#CC1(C(=O)Nc2cccc(c2)C)C(C1(C)C(=O)c1ccc(cc1)Cl)c1ccccc1

STK781765
Synonyms: 2-(4-tert-butyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
Smiles: NC(=O)CN1C(=O)NC(C1=O)(c1ccccc1)C(C)(C)C

STK686499
Synonyms: 7-ethyl-1,3-dimethyl-8-[2-(pyrrolidin-1-ylcarbonyl)phenoxy]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(Oc2ccccc2C(=O)N2CCCC2)nc2c1c(=O)n(c(=O)n2C)C

STK781769
Synonyms: methyl4-[({[5-(pyridin-3-yl)-1,3,4-thiadiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(s1)c1cccnc1

STK686501
Synonyms: N-(3,5-dichlorophenyl)-2-[(1-oxophthalazin-2(1H)-yl)acetyl]hydrazinecarbothioamide
Smiles: O=C(Cn1ncc2c(c1=O)cccc2)NNC(=S)Nc1cc(Cl)cc(c1)Cl

STK781778
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)Nc1cc(ccc1Cl)C(F)(F)F

STK781781
Synonyms: 2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)-N-(tetrahydrofuran-2-ylmethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)I)C)NCC1CCCO1

STK781784
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-(pyridin-4-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc2c(c1)OCO2)NCc1ccncc1

STK686508
Synonyms: N-(4-fluorobenzyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1onc(n1)c1ccc(cc1)C(F)(F)F

STK781791
Synonyms: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-cyclopropyl-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NC1CC1

STK781793
Synonyms: N-(2-fluorobenzyl)-3-[(4-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCc1ccccc1F

STK781794
Synonyms: 3-[(4-nitro-1H-pyrazol-1-yl)methyl]-N-(pyridin-4-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ncc(c1)[N+](=O)[O-])NCc1ccncc1

STK781798
Synonyms: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(1-phenylethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NC(c1ccccc1)C

STK781799
Synonyms: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(3-fluorobenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Fc1cccc(c1)CNC(=O)c1onc(n1)Cn1nc(c(c1C)Br)C

STK781800
Synonyms: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(2-hydroxy-2-phenylethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NCC(c1ccccc1)O

STK686512
Synonyms: 3-(1,3-benzodioxol-5-yl)-N-(4-fluorobenzyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1onc(n1)c1ccc2c(c1)OCO2

STK781803
Synonyms: 8-(3,5-dimethyl-1H-pyrazol-1-yl)-7-(2-hydroxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCn1c(nc2c1c(=O)n(c(=O)n2C)C)n1nc(cc1C)C

STK781805
Synonyms: 8-(4-ethylphenyl)-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCc1ccc(cc1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccccc1

STK781806
Synonyms: 8-(azepan-1-yl)-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1ccccc1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1

STK781813
Synonyms: methyl[1,3-dimethyl-2,6-dioxo-8-(phenylamino)-1,2,3,6-tetrahydro-7H-purin-7-yl]acetate
Smiles: COC(=O)Cn1c(Nc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK781815
Synonyms: 6-ethyl-1,3-dimethyl-7-phenyl-8-(prop-2-en-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: C=CCn1c2nc3c(n2c(c1c1ccccc1)CC)c(=O)n(c(=O)n3C)C

STK781816
Synonyms: 8-(3,5-dimethylphenyl)-1,3,6-trimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: Cc1cc(C)cc(c1)n1c2nc3c(n2c(c1c1ccccc1)C)c(=O)n(c(=O)n3C)C

STK781819
Synonyms: 4-(4-bromophenyl)-1-methyl-6-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: Brc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1ccccc1)C

STK781821
Synonyms: 4-(4-bromophenyl)-6-(4-methoxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: COc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccc(cc1)Br

STK781822
Synonyms: 4-(4-bromophenyl)-6-(4-fluorophenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: Fc1ccc(cc1)N1CC2=C(C1=O)C(NC(=O)N2C)c1ccc(cc1)Br

STK781824
Synonyms: 4-(4-methoxyphenyl)-1-methyl-6-(4-methylphenyl)-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: COc1ccc(cc1)C1NC(=O)N(C2=C1C(=O)N(C2)c1ccc(cc1)C)C

STK781825
Synonyms: 4-(1-methyl-2,5-dioxo-4-phenyl-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl)benzoicacid
Smiles: O=C1NC(c2ccccc2)C2=C(N1C)CN(C2=O)c1ccc(cc1)C(=O)O

STK781826
Synonyms: 3-(1-methyl-2,5-dioxo-4-phenyl-1,2,3,4,5,7-hexahydro-6H-pyrrolo[3,4-d]pyrimidin-6-yl)benzoicacid
Smiles: O=C1NC(c2ccccc2)C2=C(N1C)CN(C2=O)c1cccc(c1)C(=O)O

STK781827
Synonyms: 8-(4-butylphenyl)-1,3-dimethyl-7-phenyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCCCc1ccc(cc1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccccc1

STK686515
Synonyms: 2-hydroxy-3-{[(E)-(2-hydroxyphenyl)methylidene]amino}benzoicacid
Smiles: Oc1ccccc1/C=N/c1cccc(c1O)C(=O)O

STK686516
Synonyms: 3-{[N-(4-fluorophenyl)glycyl]amino}-2-hydroxybenzoicacid
Smiles: O=C(Nc1cccc(c1O)C(=O)O)CNc1ccc(cc1)F

STK781836
Synonyms: 5-(3-tert-butyl-1H-pyrazol-5-yl)-4-(2-fluorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: Fc1ccccc1n1c(S)nnc1c1[nH]nc(c1)C(C)(C)C

STK781839
Synonyms: 4-(3-chloro-4-fluorophenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1c1ccc(c(c1)Cl)F)c1ccncc1

STK781840
Synonyms: N-(3-chloro-4-fluorophenyl)-5-(pyridin-4-yl)-1,3,4-thiadiazol-2-amine
Smiles: Fc1ccc(cc1Cl)Nc1nnc(s1)c1ccncc1

STK781841
Synonyms: N-(3-chloro-4-fluorophenyl)-5-(pyridin-3-yl)-1,3,4-thiadiazol-2-amine
Smiles: Fc1ccc(cc1Cl)Nc1nnc(s1)c1cccnc1

STK686519
Synonyms: 2-amino-4-(2-chloro-6-fluorophenyl)-6-methylpyridine-3-carbonitrile
Smiles: N#Cc1c(N)nc(cc1c1c(F)cccc1Cl)C

STK686520
Synonyms: 2-amino-4-(5-bromothiophen-2-yl)-6-methylpyridine-3-carbonitrile
Smiles: N#Cc1c(N)nc(cc1c1ccc(s1)Br)C

STK686521
Synonyms: 2-amino-5,6-dimethyl-4,4'-bipyridine-3-carbonitrile
Smiles: N#Cc1c(N)nc(c(c1c1ccncc1)C)C

STK781845
Synonyms: methyl4-(2-amino-3-cyano-5,6-dimethylpyridin-4-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)c1c(C)c(C)nc(c1C#N)N

STK781846
Synonyms: 2-amino-4-[4-(diethylamino)phenyl]-5,6-dimethylpyridine-3-carbonitrile
Smiles: CCN(c1ccc(cc1)c1c(C)c(C)nc(c1C#N)N)CC

STK781847
Synonyms: 2-amino-6-ethyl-5-methyl-4-(thiophen-2-yl)pyridine-3-carbonitrile
Smiles: CCc1nc(N)c(c(c1C)c1cccs1)C#N

STK686524
Synonyms: 5-(4-bromophenyl)-7-(4-ethoxyphenyl)-6-(pyridin-3-yl)-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
Smiles: CCOc1ccc(cc1)N1C(=O)C2=C(C1c1cccnc1)C(=NCCN2)c1ccc(cc1)Br

STK781849
Synonyms: 7-(4-fluorophenyl)-5-methyl-6-(pyridin-2-yl)-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
Smiles: Fc1ccc(cc1)N1C(=O)C2=C(C1c1ccccn1)C(=NCCN2)C

STK686525
Synonyms: 4-acetyl-3-hydroxy-1-[2-(1H-imidazol-4-yl)ethyl]-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1ccccc1)CCc1c[nH]cn1

STK686526
Synonyms: 8-methoxy-6-nitro-3-{[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]carbonyl}-2H-chromen-2-one
Smiles: COc1cc(cc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)C12CC3CC(C2)CC(C1)C3)[N+](=O)[O-]

STK781850
Synonyms: 2,4-dichloro-N-[5-(pyridin-4-yl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)Nc1nnc(s1)c1ccncc1

STK781852
Synonyms: 3-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl}-2H-chromen-2-one
Smiles: O=C(c1cc2ccccc2oc1=O)N1CCN(CC1)C(=O)c1ccco1

STK781853
Synonyms: 2-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl}-3H-benzo[f]chromen-3-one
Smiles: O=C(c1ccco1)N1CCN(CC1)C(=O)c1cc2c(oc1=O)ccc1c2cccc1

STK781854
Synonyms: N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-carboxamide
Smiles: C=CCc1cccc2c1oc(=O)c(c2)C(=O)Nc1cccc(c1)c1cn2c(n1)c(C)ccc2

STK781855
Synonyms: 3-[(3,5-dimethylpiperidin-1-yl)carbonyl]-8-methoxy-2H-chromen-2-one
Smiles: COc1cccc2c1oc(=O)c(c2)C(=O)N1CC(C)CC(C1)C

STK781857
Synonyms: 3-[(3,5-dimethylpiperidin-1-yl)carbonyl]-6-methoxy-2H-chromen-2-one
Smiles: COc1ccc2c(c1)cc(c(=O)o2)C(=O)N1CC(C)CC(C1)C

STK781860
Synonyms: 2-{4-[(2-methyl-2,3-dihydro-1H-indol-1-yl)carbonyl]phenyl}hexahydro-1H-isoindole-1,3(2H)-dione
Smiles: CC1Cc2c(N1C(=O)c1ccc(cc1)N1C(=O)C3C(C1=O)CCCC3)cccc2

STK781862
Synonyms: 8-methoxy-3-[(2-methyl-2,3-dihydro-1H-indol-1-yl)carbonyl]-2H-chromen-2-one
Smiles: COc1cccc2c1oc(=O)c(c2)C(=O)N1C(C)Cc2c1cccc2

STK686528
Synonyms: 2-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)-2H-chromene-6-sulfonamide
Smiles: O=c1ccc2c(o1)ccc(c2)S(=O)(=O)NC1CC(C)(C)NC(C1)(C)C

STK781871
Synonyms: 4-chloro-3-methoxy-N-[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzenesulfonamide
Smiles: COc1cc(ccc1Cl)S(=O)(=O)Nc1cccc(c1)c1cn2c(n1)c(C)ccc2

STK781872
Synonyms: 1-({[4-(3-chloro-4-methylphenyl)piperazin-1-yl]sulfonyl}methyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-one
Smiles: Clc1cc(ccc1C)N1CCN(CC1)S(=O)(=O)CC12CCC(C2(C)C)CC1=O

STK781876
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-3-ethoxybenzenesulfonamide
Smiles: CCOc1cc(ccc1Br)S(=O)(=O)NCc1ccc2c(c1)OCO2

STK781880
Synonyms: 1-{1-[(4-fluoro-3-methoxyphenyl)sulfonyl]-3,5-dimethyl-1H-pyrazol-4-yl}ethanone
Smiles: COc1cc(ccc1F)S(=O)(=O)n1nc(c(c1C)C(=O)C)C

STK781882
Synonyms: 1-[4-(2-fluorophenyl)piperazin-1-yl]-3-[3-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
Smiles: OC(CN1CCN(CC1)c1ccccc1F)COc1cccc(c1)c1nnco1

STK781883
Synonyms: 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl6-nitro-2-oxo-2H-chromene-3-carboxylate
Smiles: O=C(c1cc2cc(ccc2oc1=O)[N+](=O)[O-])OCCn1c(C)ncc1[N+](=O)[O-]

STK781890
Synonyms: 3-butyl-2-(furan-2-yl)-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CCCCn1c(nc2c(c1=O)sc1c2c(COC)cc(n1)C)c1ccco1

STK686533
Synonyms: 3-[2-(diethylamino)ethyl]-2-ethyl-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: COCc1cc(C)nc2c1c1nc(CC)n(c(=O)c1s2)CCN(CC)CC

STK781892
Synonyms: 4,6-dimethylthieno[2,3-b]pyridine-2,3-diamine
Smiles: Cc1cc(C)c2c(n1)sc(c2N)N

STK686539
Synonyms: N-(2,4-dichlorophenyl)-2-{[3-(hydrazinylcarbonyl)-4-(hydroxymethyl)-6-methylpyridin-2-yl]sulfanyl}acetamide
Smiles: NNC(=O)c1c(SCC(=O)Nc2ccc(cc2Cl)Cl)nc(cc1CO)C

STK686540
Synonyms: 1-methyloctahydroquinolin-4(1H)-one
Smiles: O=C1CCN(C2C1CCCC2)C

STK781895
Synonyms: 6-methyl-2,3,4,9-tetrahydro-1H-beta-carbolin-1-one
Smiles: Cc1ccc2c(c1)c1CCNC(=O)c1[nH]2

STK781896
Synonyms: 6-methyl-2-thioxo-4-(trifluoromethyl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(cc([nH]c1=S)C)C(F)(F)F

STK686541
Synonyms: 1,2,5-oxadiazole-3-carboxylicacid
Smiles: OC(=O)c1cnon1

STK686542
Synonyms: 3,3-dimethyl-1-(methylamino)butan-2-one
Smiles: CNCC(=O)C(C)(C)C

STK686543
Synonyms: 1-(tert-butylamino)-3,3-dimethylbutan-2-one
Smiles: O=C(C(C)(C)C)CNC(C)(C)C

STK686544
Synonyms: 1-[tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one
Smiles: C#CCN(C(C)(C)C)CC(=O)C(C)(C)C

STK686546
Synonyms: 3,3-dimethyl-1-[(3-methylpent-1-yn-3-yl)amino]butan-2-one
Smiles: CCC(NCC(=O)C(C)(C)C)(C#C)C

STK686547
Synonyms: 3,3'-(methylimino)bis[1-(thiophen-2-yl)propan-1-one]
Smiles: CN(CCC(=O)c1cccs1)CCC(=O)c1cccs1

STK686548
Synonyms: 4-amino-1H-benzimidazole-6-carboxylicacid
Smiles: OC(=O)c1cc(N)c2c(c1)[nH]cn2

STK781899
Synonyms: ethyl7-amino-2-(pyridin-4-yl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)c1cnc2n(c1N)nc(n2)c1ccncc1

STK686549
Synonyms: 2-(2-methoxyphenyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carboxylicacid
Smiles: COc1ccccc1N1Cc2c(C1=O)c(ccc2)C(=O)O

STK781900
Synonyms: methyl4-amino-3,5-dinitrobenzoate
Smiles: COC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])N

STK781901
Synonyms: 1,1,4,4-tetraphenylbut-2-yne-1,4-diol
Smiles: OC(c1ccccc1)(c1ccccc1)C#CC(c1ccccc1)(c1ccccc1)O

STK781902
Synonyms: 5-[(4-amino-1,2,5-oxadiazol-3-yl)amino]-1H-1,2,3-triazole-4-carbonitrile
Smiles: N#Cc1nn[nH]c1Nc1nonc1N

STK781903
Synonyms: 4-ethynyl-2,2-dimethyltetrahydro-2H-pyran-4-ol
Smiles: C#CC1(O)CCOC(C1)(C)C

STK686550
Synonyms: 2-(3,4-dimethoxybenzyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carboxylicacid
Smiles: COc1cc(ccc1OC)CN1Cc2c(C1=O)c(ccc2)C(=O)O

STK686551
Synonyms: 2,4,6-trinitrobenzonitrile
Smiles: N#Cc1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

STK781904
Synonyms: 3-hydroxy-4-methoxybenzonitrile
Smiles: N#Cc1ccc(c(c1)O)OC

STK781907
Synonyms: methyl1-(4-fluorophenyl)-5-hydroxy-1H-1,2,3-triazole-4-carboxylate
Smiles: COC(=O)c1nnn(c1O)c1ccc(cc1)F

STK781908
Synonyms: [1-(3-methylphenyl)-1H-1,2,3-triazole-4,5-diyl]dimethanol
Smiles: OCc1c(CO)nnn1c1cccc(c1)C

STK781909
Synonyms: [1-(4-fluorophenyl)-1H-1,2,3-triazole-4,5-diyl]dimethanol
Smiles: OCc1c(CO)nnn1c1ccc(cc1)F

STK686555
Synonyms: tert-butyl8-(3-methoxybenzyl)-4-oxo-8-azabicyclo[3.2.1]oct-2-ene-6-carboxylate
Smiles: COc1cccc(c1)CN1C2C=CC(=O)C1C(C2)C(=O)OC(C)(C)C

STK686556
Synonyms: methyl3-amino-3-(4-ethylphenyl)propanoate
Smiles: COC(=O)CC(c1ccc(cc1)CC)N

STK781915
Synonyms: methyl5-nitro-2-oxo-1,1',2,2',5',6',7',7a'-octahydrospiro[indole-3,3'-pyrrolizine]-1'-carboxylate
Smiles: COC(=O)C1CC2(N3C1CCC3)C(=O)Nc1c2cc(cc1)[N+](=O)[O-]

STK781916
Synonyms: 5-amino-2-methyl-1H-imidazole-4-carboxamide
Smiles: NC(=O)c1nc([nH]c1N)C

STK686558
Synonyms: 3-oxo-2-(2-phenylethyl)-2,3-dihydro-1H-indole-4-carboxylicacid
Smiles: OC(=O)c1cccc2c1C(=O)C(N2)CCc1ccccc1

STK686560
Synonyms: 2-[4-(dimethylamino)benzyl]-3-oxo-2,3-dihydro-1H-indole-4-carboxylicacid
Smiles: O=C1C(Cc2ccc(cc2)N(C)C)Nc2c1c(ccc2)C(=O)O

STK781917
Synonyms: 2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-N-(2-hydroxyethyl)acetamide
Smiles: OCCNC(=O)Cn1ccc(=O)[nH]c1=O

STK686563
Synonyms: 1-[2-(3,4-dimethoxyphenyl)ethyl]octahydroquinolin-4(1H)-one
Smiles: COc1cc(CCN2CCC(=O)C3C2CCCC3)ccc1OC

STK686564
Synonyms: 1-[3-(dimethylamino)propyl]octahydroquinolin-4(1H)-one
Smiles: CN(CCCN1CCC(=O)C2C1CCCC2)C

STK781918
Synonyms: N,N'-bis(4-fluorophenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Smiles: Fc1ccc(cc1)Nc1nc2nonc2nc1Nc1ccc(cc1)F

STK781919
Synonyms: 6-methyl-4-thioxo-4,5-dihydrofuro[3,4-c]pyridin-3(1H)-one
Smiles: Cc1cc2COC(=O)c2c(=S)[nH]1

STK781921
Synonyms: 3-amino-6-ethyl-5-methylthieno[2,3-b]pyridine-2-carboxamide
Smiles: CCc1nc2sc(c(c2cc1C)N)C(=O)N

STK686570
Synonyms: 1,3,5-trimethylpiperidin-4-one
Smiles: CC1CN(C)CC(C1=O)C

STK686571
Synonyms: 1-ethyl-2,3-dimethylpiperidin-4-one
Smiles: CCN1CCC(=O)C(C1C)C

STK781923
Synonyms: 5-[(1,3-benzodioxol-5-ylmethyl)amino]-1H-pyrazole-4-carbonitrile
Smiles: N#Cc1cn[nH]c1NCc1ccc2c(c1)OCO2

STK686572
Synonyms: 2,4-dichloro-6-(6-methoxy-2,3,4,9-tetrahydro-1H-beta-carbolin-1-yl)phenol
Smiles: COc1ccc2c(c1)c1CCNC(c1[nH]2)c1cc(Cl)cc(c1O)Cl

STK781924
Synonyms: 4-(4-amino-3-nitrophenyl)phthalazin-1-ol
Smiles: [O-][N+](=O)c1cc(ccc1N)c1nnc(c2c1cccc2)O

STK781925
Synonyms: methyl1'-methyl-5-nitro-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-4'-carboxylate
Smiles: [O-][N+](=O)c1cc2C3(CC(CN3C)C(=O)OC)C(=O)Nc2cc1

STK781926
Synonyms: 2-(4-fluorophenyl)-5,7-dimethylimidazo[1,2-a]pyridin-3-amine
Smiles: Fc1ccc(cc1)c1nc2n(c1N)c(C)cc(c2)C

STK686573
Synonyms: methyl5-amino-2-oxo-1,1',2,2',5',6',7',7a'-octahydrospiro[indole-3,3'-pyrrolizine]-1'-carboxylate
Smiles: COC(=O)C1CC2(N3C1CCC3)C(=O)Nc1c2cc(N)cc1

STK781927
Synonyms: 3H-imidazo[4,5-b]pyridin-2-ylacetonitrile
Smiles: N#CCc1nc2c([nH]1)nccc2

STK686574
Synonyms: 1-[4-(cyanomethyl)phenyl]-1,2,3,5,6,7,8,8a-octahydroquinolinium-4-olate
Smiles: N#CCc1ccc(cc1)[NH+]1CCC(=C2C1CCCC2)[O-]

STK781928
Synonyms: (7aR)-6-(4-methylphenyl)-3-(thiophen-2-yl)-1H-imidazo[1,5-c][1,3]thiazole-5,7(6H,7aH)-dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2N(C1=O)C(SC2)c1cccs1

STK781929
Synonyms: 1-benzyl-5-(methoxymethyl)-2-(4-methoxyphenyl)-7-methyl-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2Cc1ccccc1)c1ccc(cc1)OC

STK686575
Synonyms: 4-(methoxymethyl)-6-methyl-3-[(phenylcarbonyl)amino]-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COCc1cc(C)nc2c1c(NC(=O)c1ccccc1)c(s2)C(=O)NCC12CC3CC(C2)CC(C1)C3

STK781931
Synonyms: ethyl4-(methoxymethyl)-6-methyl-3-[(3-methylbutanoyl)amino]thieno[2,3-b]pyridine-2-carboxylate
Smiles: CCOC(=O)c1sc2c(c1NC(=O)CC(C)C)c(COC)cc(n2)C

STK686577
Synonyms: 3-[2-(diethylamino)ethyl]-9-(methoxymethyl)-7-methyl-2-phenylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: COCc1cc(C)nc2c1c1nc(c3ccccc3)n(c(=O)c1s2)CCN(CC)CC

STK781934
Synonyms: 1-benzyl-2-(4-fluorophenyl)-5-(methoxymethyl)-7-methyl-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2Cc1ccccc1)c1ccc(cc1)F

STK781935
Synonyms: 1-benzyl-2-(4-ethoxy-3-methoxyphenyl)-5-(methoxymethyl)-7-methyl-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2Cc1ccccc1)c1ccc(c(c1)OC)OCC

STK781937
Synonyms: 2-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-1-(2-chloropyridin-3-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1scc(c1)Cn1cnc3c1cccc3)C(=O)CCC2)c1cccnc1Cl

STK781938
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-2-{[(4E)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylideneamino]oxy}acetamide
Smiles: O=C(Nc1ccc(cc1)OC(Cl)(F)F)CO/N=C/1\CCCc2c1non2

STK781939
Synonyms: N-(1,3-benzodioxol-5-yl)-2-({4-methyl-5-[(2-oxo-4-phenylpyrrolidin-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1C)CN1CC(CC1=O)c1ccccc1

STK781940
Synonyms: [4-amino-2-(ethylamino)-1,3-thiazol-5-yl](4-chlorophenyl)methanone
Smiles: CCNc1nc(c(s1)C(=O)c1ccc(cc1)Cl)N

STK781944
Synonyms: 1,2,4-trifluoro-3-methoxydibenzo[b,f][1,4]oxazepine
Smiles: COc1c(F)c2Oc3ccccc3N=Cc2c(c1F)F

STK686582
Synonyms: 1,1'-buta-1,3-diyne-1,4-diyldicycloheptanol
Smiles: OC1(CCCCCC1)C#CC#CC1(O)CCCCCC1

STK781945
Synonyms: 5,7-dimethyl-1,3-diaza-2,2'-spirobi[tricyclo[3.3.1.1~3,7~]decan]-6-one
Smiles: O=C1C2(C)CN3CC1(C)CN(C2)C13C2CC3CC1CC(C2)C3

STK781946
Synonyms: ethyl2-amino-7,7-dimethyl-5-oxo-4-[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CC(C2)(C)C

STK781947
Synonyms: ethyl2-amino-5-oxo-4-[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CCC2

STK781949
Synonyms: N-{4-[6-amino-6a-cyano-3,4-bis(ethylsulfanyl)-1,6a-dihydropyrrolo[3,4-c]pyrrol-1-yl]phenyl}acetamide
Smiles: CCSC1=NC(C2(C1=C(SCC)N=C2N)C#N)c1ccc(cc1)NC(=O)C

STK781950
Synonyms: methyl1-[(2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}phenyl)sulfonyl]prolinate
Smiles: COC(=O)C1CCCN1S(=O)(=O)c1ccccc1NC(=O)c1cc(OC)c(c(c1)OC)OC

STK781955
Synonyms: 4-chloro-N-(1H-indazol-6-yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)[nH]nc2

STK781956
Synonyms: N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)Nc1ccc2c(c1)[nH]nc2

STK781957
Synonyms: N-(1H-indazol-6-yl)-5-methoxy-2,4-dimethylbenzenesulfonamide
Smiles: COc1cc(c(cc1C)C)S(=O)(=O)Nc1ccc2c(c1)[nH]nc2

STK781958
Synonyms: 4-chloro-N-(1H-indazol-6-yl)-2,5-dimethylbenzenesulfonamide
Smiles: Cc1cc(Cl)c(cc1S(=O)(=O)Nc1ccc2c(c1)[nH]nc2)C

STK781959
Synonyms: 2,5-diethoxy-N-(1H-indazol-6-yl)benzenesulfonamide
Smiles: CCOc1ccc(cc1S(=O)(=O)Nc1ccc2c(c1)[nH]nc2)OCC

STK781960
Synonyms: 3,4-dichloro-N-(1H-indazol-6-yl)benzenesulfonamide
Smiles: Clc1cc(ccc1Cl)S(=O)(=O)Nc1ccc2c(c1)[nH]nc2

STK781965
Synonyms: 1-amino-3-methoxy-9-oxo-10-phenyl-5,6,7,8,9,10-hexahydrobenzo[b][1,6]naphthyridine-4-carbonitrile
Smiles: N#Cc1c(OC)nc(c2c1NC1=C(C2c2ccccc2)C(=O)CCC1)N

STK686588
Synonyms: 1-(1H-benzimidazol-1-yl)-3-(biphenyl-4-yloxy)propan-2-ol
Smiles: OC(Cn1cnc2c1cccc2)COc1ccc(cc1)c1ccccc1

STK781966
Synonyms: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(1H-tetrazol-1-yl)propanamide
Smiles: O=C(Nc1cc2OCOc2cc1C(=O)C)CCn1cnnn1

STK781968
Synonyms: 2-(4-bromo-5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(4-bromo-1H-pyrazol-1-yl)ethanone
Smiles: Brc1cnn(c1)C(=O)Cn1nc(c(c1C)Br)[N+](=O)[O-]

STK781971
Synonyms: 1-(4-iodo-1H-pyrazol-1-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethanone
Smiles: Ic1cnn(c1)C(=O)Cn1nc(cc1C)[N+](=O)[O-]

STK781973
Synonyms: 1-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)-2-(3-nitro-1H-pyrazol-1-yl)ethanone
Smiles: [O-][N+](=O)c1ccn(n1)CC(=O)n1nc(c(c1C)I)C

STK781974
Synonyms: 1-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)-2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethanone
Smiles: [O-][N+](=O)c1nn(c(c1)C)CC(=O)n1nc(c(c1C)I)C

STK781978
Synonyms: N-(1H-benzimidazol-2-ylmethyl)-3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(c(c1C)Br)C)NCc1nc2c([nH]1)cccc2

STK781979
Synonyms: 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(4-methylcyclohexyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: CC1CCC(CC1)NC(=O)c1onc(n1)Cn1nc(c(c1C)Br)C

STK781980
Synonyms: 3-[(3-nitro-1H-pyrazol-1-yl)methyl]-N-(2-phenylethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1ccc(n1)[N+](=O)[O-])NCCc1ccccc1

STK781991
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}acetamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)COc1nsnc1N1CCOCC1

STK686593
Synonyms: 3-({[2-(1,3-thiazol-5-yl)-1H-benzimidazol-1-yl]acetyl}amino)benzoicacid
Smiles: O=C(Cn1c(nc2c1cccc2)c1cncs1)Nc1cccc(c1)C(=O)O

STK781992
Synonyms: 2-{[(4E)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylideneamino]oxy}-N-(4-fluorobenzyl)acetamide
Smiles: O=C(NCc1ccc(cc1)F)CO/N=C/1\CCCc2c1non2

STK686594
Synonyms: 4,5-dimethoxy-2-[({5-[4-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetyl)amino]benzoicacid
Smiles: COc1cc(NC(=O)Cn2nnc(n2)c2ccc(cc2)C(F)(F)F)c(cc1OC)C(=O)O

STK781995
Synonyms: (6-bromo-1,3-benzodioxol-5-yl)methyl4-(1H-pyrazol-1-yl)benzoate
Smiles: O=C(c1ccc(cc1)n1cccn1)OCc1cc2OCOc2cc1Br

STK781997
Synonyms: N-(2,4-dichlorophenyl)-1-ethyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: CCn1nc(cc1C(=O)Nc1ccc(cc1Cl)Cl)C(F)(F)F

STK782001
Synonyms: 2-phenyl-N-[2-(trifluoromethyl)-1H-benzimidazol-7-yl]butanamide
Smiles: CCC(c1ccccc1)C(=O)Nc1cccc2c1[nH]c(n2)C(F)(F)F

STK782002
Synonyms: N-(2-ethoxyphenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: CCOc1ccccc1NC(=O)c1cc(nn1C)C(F)(F)F

STK782005
Synonyms: N-(4-fluorobenzyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1cc(nn1C)C(F)(F)F

STK782006
Synonyms: N-[4-(acetylamino)phenyl]-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1C)C(F)(F)F)Nc1ccc(cc1)NC(=O)C

STK782007
Synonyms: N-(2,4-difluorophenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: Fc1ccc(c(c1)F)NC(=O)c1cc(nn1C)C(F)(F)F

STK782008
Synonyms: N-(4-bromo-2-fluorophenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: Brc1ccc(c(c1)F)NC(=O)c1cc(nn1C)C(F)(F)F

STK782009
Synonyms: N-(3,4-dimethoxybenzyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: COc1cc(CNC(=O)c2cc(nn2C)C(F)(F)F)ccc1OC

STK782010
Synonyms: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1C)C(F)(F)F)Nc1ccc2c(c1)OCCO2

STK782013
Synonyms: N-(3-methoxyphenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: COc1cccc(c1)NC(=O)c1cc(nn1C)C(F)(F)F

STK782014
Synonyms: N-(2-carbamoylphenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Smiles: O=C(c1cc(nn1C)C(F)(F)F)Nc1ccccc1C(=O)N

STK782016
Synonyms: 2-chloro-6-fluorobenzyl4-[5-(2-chloro-6-fluorobenzyl)-1H-tetrazol-1-yl]benzoate
Smiles: O=C(c1ccc(cc1)n1nnnc1Cc1c(F)cccc1Cl)OCc1c(F)cccc1Cl

STK782017
Synonyms: 1-(1H-benzimidazol-1-yl)-3-(morpholin-4-yl)propan-2-ol
Smiles: OC(Cn1cnc2c1cccc2)CN1CCOCC1

STK782018
Synonyms: N-(2-{1-[2-(4-chlorophenoxy)ethyl]-1H-benzimidazol-2-yl}ethyl)furan-2-carboxamide
Smiles: Clc1ccc(cc1)OCCn1c(CCNC(=O)c2ccco2)nc2c1cccc2

STK686597
Synonyms: (2Z)-2-{(2Z)-[(1S,2S,5R)-2-(4-ethyl-3-{[5-(4-methylphenyl)-2H-tetrazol-2-yl]methyl}-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl)-6,8-dioxabicyclo[3.2.1]oct-4-ylidene]hydrazinylidene}-1,3-thiazolidin-4-
Smiles: CCn1c(Cn2nnc(n2)c2ccc(cc2)C)nn(c1=S)[C@H]1C/C(=N/N=C/2\SCC(=O)N2)/[C@H]2O[C@@H]1CO2

STK782019
Synonyms: N-[4-hydroxy-4,5-dimethyl-5-(2-methyl-2-phenylpropyl)-2-oxo-1,3-oxazolidin-3-yl]benzamide
Smiles: O=C(c1ccccc1)NN1C(=O)OC(C1(C)O)(C)CC(c1ccccc1)(C)C

STK686598
Synonyms: 4-hydroxy-3-[2-(1H-imidazol-5-yl)ethyl]-4,5-dimethyl-5-(2-methyl-2-phenylpropyl)-1,3-oxazolidin-2-one
Smiles: O=C1OC(C(N1CCc1[nH]cnc1)(C)O)(C)CC(c1ccccc1)(C)C

STK782021
Synonyms: 3-[3-(1H-benzimidazol-1-yl)propyl]-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(N1CCCn1cnc3c1cccc3)(C)O)CCCCC2

STK782022
Synonyms: N-(3,4-dimethoxyphenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CN1C(=O)OC(C1(C)O)(C)C

STK782023
Synonyms: N-(3,4-dimethoxyphenyl)-2-(4-hydroxy-4-methyl-2-oxo-1-oxa-3-azaspiro[4.5]dec-3-yl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CN1C(=O)OC2(C1(C)O)CCCCC2

STK782025
Synonyms: 3-cyclopropyl-5-ethyl-4-hydroxy-4,5-dimethyl-1,3-oxazolidin-2-one
Smiles: CCC1(C)OC(=O)N(C1(C)O)C1CC1

STK782026
Synonyms: 3a,5,5,9b-tetramethyl-1-(2-phenylethyl)-3a,4,5,9b-tetrahydronaphtho[1,2-d][1,3]oxazol-2(1H)-one
Smiles: O=C1OC2(C(N1CCc1ccccc1)(C)c1ccccc1C(C2)(C)C)C

STK782027
Synonyms: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-4,5-dimethyl-5-(2-methyl-2-phenylpropyl)-1,3-oxazolidin-2-one
Smiles: COc1cc(CCN2C(=O)OC(C2(C)O)(C)CC(c2ccccc2)(C)C)ccc1OC

STK782028
Synonyms: 8,10-dimethoxy-1,1,10b-trimethyl-1,10b-dihydro[1,3]oxazolo[4,3-a]phthalazine-3,6(5H)-dione
Smiles: COc1cc(OC)c2c(c1)C(=O)NN1C2(C)C(C)(C)OC1=O

STK782029
Synonyms: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3a,5,5,9b-tetramethyl-3a,4,5,9b-tetrahydronaphtho[1,2-d][1,3]oxazol-2(1H)-one
Smiles: COc1cc(CCN2C(=O)OC3(C2(C)c2ccccc2C(C3)(C)C)C)ccc1OC

STK686600
Synonyms: 4-(3,3-dimethyl-5-thioxo-1,2,4-triazolidin-1-yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1NC(NC1=S)(C)C

STK686601
Synonyms: N-(1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-2-(pyridin-2-ylsulfanyl)acetamide
Smiles: O=C(NC1=NN(CC1)c1ccccc1)CSc1ccccn1

STK782034
Synonyms: 3-amino-N-(1,3-benzodioxol-5-ylmethyl)-6-(propan-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b][1,6]naphthyridine-2-carboxamide
Smiles: CC(N1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NCc1ccc2c(c1)OCO2)C

STK782035
Synonyms: 3-bromo-6,7,8,9-tetrahydro-5H-cyclohepta[b][1,2]thiazolo[4,5-e]pyridine
Smiles: Brc1nsc2c1cc1CCCCCc1n2

STK686603
Synonyms: 3-amino-6-methyl-N-(propan-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b][1,6]naphthyridine-2-carboxamide
Smiles: CN1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NC(C)C

STK782041
Synonyms: N-(diphenylmethyl)-2-methoxy-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)benzamide
Smiles: COc1ccc(cc1C(=O)NC(c1ccccc1)c1ccccc1)C12CC3CC(C2)CC(C1)C3

STK686607
Synonyms: 2-[(2,2,2-trifluoroethoxy)methyl]furan-3-carboxylicacid
Smiles: OC(=O)c1ccoc1COCC(F)(F)F

STK686608
Synonyms: N-[4-(3-methyl-1H-pyrazol-1-yl)phenyl]-7-(1H-tetrazol-1-yl)dibenzo[b,d]furan-2-sulfonamide
Smiles: Cc1ccn(n1)c1ccc(cc1)NS(=O)(=O)c1ccc2c(c1)c1ccc(cc1o2)n1cnnn1

STK686609
Synonyms: N-[4-(3-methyl-1H-pyrazol-1-yl)phenyl]-4-(5-oxopyrrolidin-3-yl)benzenesulfonamide
Smiles: O=C1NCC(C1)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)n1ccc(n1)C

STK686610
Synonyms: (2,6,6-trimethyl-4-oxo-1-phenyl-4,5,6,7-tetrahydro-1H-indol-3-yl)aceticacid
Smiles: OC(=O)Cc1c(C)n(c2c1C(=O)CC(C2)(C)C)c1ccccc1

STK782045
Synonyms: 2-amino-5-(4-bromophenyl)furan-3-carbonitrile
Smiles: N#Cc1cc(oc1N)c1ccc(cc1)Br

STK782047
Synonyms: pyridin-2-ylmethyl5-amino-5-oxo-3-phenylpentanoate
Smiles: NC(=O)CC(c1ccccc1)CC(=O)OCc1ccccn1

STK782049
Synonyms: 4-[(4-chlorophenyl)sulfonyl]-3-methyl-2-phenylmorpholine
Smiles: Clc1ccc(cc1)S(=O)(=O)N1CCOC(C1C)c1ccccc1

STK686611
Synonyms: 3-(ethylamino)-5-(phenylamino)-6a,7,8,9,10,10a-hexahydro-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: CCNc1cc(Nc2ccccc2)c2c3c1noc3C1C(C2=O)CCCC1

STK686614
Synonyms: 2,4-bis(4-chlorophenoxy)-1-nitrobenzene
Smiles: Clc1ccc(cc1)Oc1ccc(c(c1)Oc1ccc(cc1)Cl)[N+](=O)[O-]

STK782050
Synonyms: ethyl3-oxo-2-phenyl-1,2,4-triazaspiro[4.4]nonane-1-carboxylate
Smiles: CCOC(=O)N1N(C(=O)NC21CCCC2)c1ccccc1

STK782052
Synonyms: 3-amino-2-methoxy-5,6,7,8-tetrahydro-4H-thiochromen-4-one
Smiles: COc1sc2CCCCc2c(=O)c1N

STK782054
Synonyms: 5-[(2-methyl-2,3-dihydro-1H-indol-1-yl)carbonyl]-2-(4-methylphenyl)-1H-isoindole-1,3(2H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)N1C(C)Cc2c1cccc2

STK782056
Synonyms: 6-amino-3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,2,4-oxadiazine-5-carbonitrile
Smiles: Nc1o[nH]c(=O)n(c1C#N)CC=C

STK782057
Synonyms: 6,8,9-trifluoro-7-methoxydibenzo[b,f][1,4]oxazepine
Smiles: COc1c(F)c2Oc3ccccc3C=Nc2c(c1F)F

STK686616
Synonyms: N-[2-methyl-1-(pyrrolidin-1-yl)propan-2-yl]quinoline-2-carboxamide
Smiles: O=C(c1ccc2c(n1)cccc2)NC(CN1CCCC1)(C)C

STK782060
Synonyms: 6-ethyl-5-methyl-2-[(pyridin-3-ylmethyl)sulfanyl]-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2cccnc2)nc(c(c1C(F)(F)F)C)CC

STK782061
Synonyms: methylS-benzyl-N-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetyl}cysteinate
Smiles: COC(=O)C(NC(=O)CSc1nccn1C)CSCc1ccccc1

STK782063
Synonyms: 4-(4-methyl-1-oxophthalazin-2(1H)-yl)-N-(pyridin-3-ylmethyl)benzamide
Smiles: O=C(c1ccc(cc1)n1nc(C)c2c(c1=O)cccc2)NCc1cccnc1

STK782064
Synonyms: 4-methyl-2-[4-(piperidin-1-ylcarbonyl)phenyl]phthalazin-1(2H)-one
Smiles: O=C(c1ccc(cc1)n1nc(C)c2c(c1=O)cccc2)N1CCCCC1

STK782065
Synonyms: 4-methyl-2-[4-(morpholin-4-ylcarbonyl)phenyl]phthalazin-1(2H)-one
Smiles: O=C(c1ccc(cc1)n1nc(C)c2c(c1=O)cccc2)N1CCOCC1

STK782066
Synonyms: 4-(4-methyl-1-oxophthalazin-2(1H)-yl)-N-[4-(piperidin-1-ylcarbonyl)phenyl]benzamide
Smiles: O=C(c1ccc(cc1)n1nc(C)c2c(c1=O)cccc2)Nc1ccc(cc1)C(=O)N1CCCCC1

STK782067
Synonyms: 2-{4-[(4-benzylpiperidin-1-yl)carbonyl]phenyl}-4-methylphthalazin-1(2H)-one
Smiles: O=C(c1ccc(cc1)n1nc(C)c2c(c1=O)cccc2)N1CCC(CC1)Cc1ccccc1

STK686620
Synonyms: 1-(4H-[1,2,4]triazolo[1,5-a]benzimidazol-4-yl)ethanone
Smiles: CC(=O)n1c2ncnn2c2c1cccc2

STK782068
Synonyms: {[6-amino-1-(furan-2-ylmethyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc(=O)cc(n1Cc1ccco1)N

STK686621
Synonyms: 3,4-dimethyl-1-(1-phenylethyl)-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: O=c1cc(C)c2c([nH]1)n(nc2C)C(c1ccccc1)C

STK782069
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Smiles: O=C(C1COc2c(O1)cccc2)Nc1ccc(cc1)OC(Cl)(F)F

STK782070
Synonyms: N-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Smiles: O=C(C1COc2c(O1)cccc2)Nc1ccc(cc1)OC(F)(F)F

STK782074
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-cycloheptyl-3-hydroxy-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: O=C1CSC(c2c(N1)n(nc2O)C1CCCCCC1)c1ccc2c(c1)OCO2

STK782078
Synonyms: 8-methyl-2-(morpholin-4-yl)-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one
Smiles: CN1CCn2c1nc(nc2=O)N1CCOCC1

STK782079
Synonyms: 8-methyl-2-(piperidin-1-yl)-7,8-dihydroimidazo[1,2-a][1,3,5]triazin-4(6H)-one
Smiles: CN1CCn2c1nc(nc2=O)N1CCCCC1

STK686622
Synonyms: ethyl4-[(4Z)-4-(4-chlorobenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-imidazol-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=N/C(=C\c2ccc(cc2)Cl)/C1=O)C

STK686625
Synonyms: 2-(1,2-dimethyl-1H-indol-3-yl)-5-methyl-7-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1c2ccccc2n(c1C)C)C

STK782085
Synonyms: 5-butyl-7-methyl-2-(5-nitrofuran-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(o1)[N+](=O)[O-])C

STK782089
Synonyms: 4,6-dimethyl-3-[7-(trifluoromethyl)-2,3-dihydro-1H-1,4-diazepin-5-yl]pyridin-2(1H)-one
Smiles: FC(C1=CC(=NCCN1)c1c(C)cc([nH]c1=O)C)(F)F

STK782090
Synonyms: 2-(1,3-benzothiazol-2-yl)pyridine-3-carboxylicacid
Smiles: OC(=O)c1cccnc1c1nc2c(s1)cccc2

STK782093
Synonyms: N-(2-fluorophenyl)-7,7-dimethyl-2,3-dioxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C1C2CCC(C1=O)(C2(C)C)C(=O)Nc1ccccc1F

STK782095
Synonyms: 7,7-dimethyl-2,3-dioxo-N-[2-(trifluoromethyl)phenyl]bicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C1C2CCC(C1=O)(C2(C)C)C(=O)Nc1ccccc1C(F)(F)F

STK782097
Synonyms: N-(4-fluorophenyl)-7,7-dimethyl-2,3-dioxobicyclo[2.2.1]heptane-1-carboxamide
Smiles: O=C(C12CCC(C2(C)C)C(=O)C1=O)Nc1ccc(cc1)F

STK782101
Synonyms: 2,3-dicyano-N-(2-fluorophenyl)-8,9,9-trimethyl-7,8-dihydro-5,8-methanoquinoxaline-5(6H)-carboxamide
Smiles: N#Cc1nc2c(nc1C#N)C1(C(C2(CC1)C(=O)Nc1ccccc1F)(C)C)C

STK782103
Synonyms: 5-[(6-fluoro-2-methyl-3,4-dihydroquinolin-1(2H)-yl)carbonyl]-9,9-dimethyl-5,6,7,8-tetrahydro-5,8-methanoquinoxaline-2,3-dicarbonitrile
Smiles: N#Cc1nc2c(nc1C#N)C1C(C2(CC1)C(=O)N1C(C)CCc2c1ccc(c2)F)(C)C

STK782104
Synonyms: 2,3-dicyano-9,9-dimethyl-N-[3-(trifluoromethyl)phenyl]-7,8-dihydro-5,8-methanoquinoxaline-5(6H)-carboxamide
Smiles: N#Cc1nc2c(nc1C#N)C1C(C2(CC1)C(=O)Nc1cccc(c1)C(F)(F)F)(C)C

STK782105
Synonyms: 2,3-dicyano-9,9-dimethyl-N-[4-(trifluoromethoxy)phenyl]-7,8-dihydro-5,8-methanoquinoxaline-5(6H)-carboxamide
Smiles: N#Cc1nc2c(nc1C#N)C1C(C2(CC1)C(=O)Nc1ccc(cc1)OC(F)(F)F)(C)C

STK686634
Synonyms: 2,3-dicyano-9,9-dimethyl-N-[4-(trifluoromethyl)phenyl]-7,8-dihydro-5,8-methanoquinoxaline-5(6H)-carboxamide
Smiles: N#Cc1nc2c(nc1C#N)C1C(C2(CC1)C(=O)Nc1ccc(cc1)C(F)(F)F)(C)C

STK782106
Synonyms: N-(2-fluorophenyl)-1H-benzimidazole-6-carboxamide
Smiles: O=C(c1ccc2c(c1)[nH]cn2)Nc1ccccc1F

STK782107
Synonyms: N-[2-chloro-5-(trifluoromethyl)phenyl]-1H-benzimidazole-6-carboxamide
Smiles: O=C(c1ccc2c(c1)[nH]cn2)Nc1cc(ccc1Cl)C(F)(F)F

STK782108
Synonyms: N-(3,4-difluorophenyl)-1H-benzimidazole-6-carboxamide
Smiles: O=C(c1ccc2c(c1)[nH]cn2)Nc1ccc(c(c1)F)F

STK782110
Synonyms: 6-amino-4-(4-{[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}thiophen-2-yl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1scc(c1)CSc1nnc(s1)N)c(C)[nH]n2

STK782112
Synonyms: methyl2-amino-5-oxo-4-[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: COC(=O)C1=C(N)OC2=C(C1c1scc(c1)Cn1ncnc1)C(=O)CCC2

STK782113
Synonyms: methyl6-amino-5-cyano-2-methyl-4-[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1scc(c1)Cn1cncn1)C#N)N

STK782116
Synonyms: (2Z)-2-{[4-(1H-1,2,4-triazol-1-ylmethyl)thiophen-2-yl]methylidene}hydrazinecarboxamide
Smiles: NC(=O)N/N=C\c1cc(cs1)Cn1cncn1

STK686639
Synonyms: 2,5-dioxo-1-phenyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: O=C(c1cc2C(=O)CCCc2n(c1=O)c1ccccc1)NC1CC(C)(C)NC(C1)(C)C

STK782120
Synonyms: N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-2,5-dioxo-1-phenyl-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: O=C(c1cc2C(=O)CCCc2n(c1=O)c1ccccc1)NCCc1c(C)[nH]c2c1cc(cc2)OC(F)(F)F

STK782121
Synonyms: 1-(4-methoxyphenyl)-7,7-dimethyl-N-[2-(2-methyl-1H-indol-3-yl)ethyl]-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: COc1ccc(cc1)n1c2CC(C)(C)CC(=O)c2cc(c1=O)C(=O)NCCc1c(C)[nH]c2c1cccc2

STK782122
Synonyms: 1-(4-chlorophenyl)-N-(3-methylpent-1-yn-3-yl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: CCC(NC(=O)c1cc2C(=O)CCCc2n(c1=O)c1ccc(cc1)Cl)(C#C)C

STK782124
Synonyms: 3-[1-(2-fluorophenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]-4,6-dimethylpyridin-2(1H)-one
Smiles: COc1ccc(cc1)C1CC(=NN1c1ccccc1F)c1c(C)cc([nH]c1=O)C

STK782126
Synonyms: 1-[4-(3-chlorophenyl)piperazin-1-yl]-3-[3-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
Smiles: OC(CN1CCN(CC1)c1cccc(c1)Cl)COc1cccc(c1)c1nnco1

STK782127
Synonyms: 1-[4-(4-fluorophenyl)piperazin-1-yl]-3-[3-(1,3,4-oxadiazol-2-yl)phenoxy]propan-2-ol
Smiles: OC(CN1CCN(CC1)c1ccc(cc1)F)COc1cccc(c1)c1nnco1

STK782128
Synonyms: N-(pyridin-3-ylmethyl)-1,2-dihydroacenaphthylene-3-sulfonamide
Smiles: O=S(=O)(c1ccc2c3c1CCc3ccc2)NCc1cccnc1

STK686641
Synonyms: 2-{[3-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]carbamoyl}cyclohexanecarboxylicacid
Smiles: O=C(C1CCCCC1C(=O)O)Nc1cccc(c1)c1cn2c(n1)c(C)ccc2

STK686646
Synonyms: 3-{4-amino-3-[(4-fluorobenzyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}propanoicacid
Smiles: OC(=O)CCc1nnc(n(c1=O)N)SCc1ccc(cc1)F

STK686649
Synonyms: 3-{4-amino-3-[(3-chlorobenzyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}propanoicacid
Smiles: OC(=O)CCc1nnc(n(c1=O)N)SCc1cccc(c1)Cl

STK782132
Synonyms: 6-[(3-acetyl-6-methyl-4-oxo-4H-pyran-2-yl)amino]-1,3-benzoxazol-2(3H)-one
Smiles: Cc1oc(Nc2ccc3c(c2)oc(=O)[nH]3)c(c(=O)c1)C(=O)C

STK782139
Synonyms: 1-amino-2-[(2-hydroxyethyl)amino]-4-[(3-methylphenyl)amino]anthracene-9,10-dione
Smiles: OCCNc1cc(Nc2cccc(c2)C)c2c(c1N)C(=O)c1c(C2=O)cccc1

STK686659
Synonyms: N-(2-hydroxyethyl)-4-(hydroxymethyl)-6-methyl-2-oxo-1,2-dihydropyridine-3-carboxamide
Smiles: OCCNC(=O)c1c(CO)cc([nH]c1=O)C

STK686661
Synonyms: 5-hydrazinyl-7-methyl-1-{[3-(3-nitrophenyl)-1H-pyrazol-4-yl]methyl}pyrido[3,4-d]pyridazin-4(3H)-one
Smiles: NNc1nc(C)cc2c1c(=O)[nH]nc2Cc1c[nH]nc1c1cccc(c1)[N+](=O)[O-]

STK782141
Synonyms: 2-amino-4-(2-chloro-6-fluorophenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1c(F)cccc1Cl)CCCC2

STK686664
Synonyms: butane-1,4-diylbis[3,3,3-trifluoro-2-(trifluoromethyl)propanoate]
Smiles: O=C(C(C(F)(F)F)C(F)(F)F)OCCCCOC(=O)C(C(F)(F)F)C(F)(F)F

STK782144
Synonyms: 1-({3-[ethyl(phenyl)amino]propyl}amino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCN(c1ccccc1)CCCNc1cc(C)c(c2n1c1ccccc1n2)C#N

STK782145
Synonyms: N-ethyl-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]-3-phenylpropanamide
Smiles: CCN(C(=O)CCc1ccccc1)Cc1cc2ccccc2[nH]c1=O

STK686667
Synonyms: 1-(hex-2-yn-1-yl)-4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazine
Smiles: CCCC#CCN1CCN(CC1)C12CC3CC(C2)CC(C1)C3

STK686668
Synonyms: 5-[(2,2,6,6-tetramethylpiperidin-4-yl)carbamoyl]-1H-imidazole-4-carboxylicacid
Smiles: O=C(c1[nH]cnc1C(=O)O)NC1CC(C)(C)NC(C1)(C)C

STK782147
Synonyms: prop-2-en-1-yl6-chloro-2,3,4,9-tetrahydro-1H-carbazole-7-carboxylate
Smiles: C=CCOC(=O)c1cc2[nH]c3c(c2cc1Cl)CCCC3

STK782149
Synonyms: {[6-amino-1-(3-chlorophenyl)-4-oxo-1,4-dihydropyrimidin-2-yl]sulfanyl}acetonitrile
Smiles: N#CCSc1nc(=O)cc(n1c1cccc(c1)Cl)N

STK782150
Synonyms: N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-(1H-tetrazol-1-yl)propanamide
Smiles: CCSc1nnc(s1)NC(=O)CCn1cnnn1

STK782154
Synonyms: 6-{(E)-2-[3-(thiophen-2-yl)-1H-pyrazol-4-yl]ethenyl}-4-(trifluoromethyl)pyrimidin-2(1H)-one
Smiles: O=c1[nH]c(/C=C/c2c[nH]nc2c2cccs2)cc(n1)C(F)(F)F

STK782156
Synonyms: N-(4-methoxybenzyl)-2-{5-[4-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamide
Smiles: COc1ccc(cc1)CNC(=O)Cn1nnc(n1)c1ccc(cc1)C(F)(F)F

STK782159
Synonyms: 2-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-5-(4-methoxyphenyl)-2H-tetrazole
Smiles: COc1ccc(cc1)c1nnn(n1)Cc1cc2OCOc2cc1Br

STK686676
Synonyms: {4-[2-(2-chloro-6-fluorobenzyl)-2H-tetrazol-5-yl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccc(cc1)c1nnn(n1)Cc1c(F)cccc1Cl

STK686677
Synonyms: 10-({4-methyl-5-[(1H-tetrazol-5-ylmethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)acridin-9(10H)-one
Smiles: Cn1c(nnc1Cn1c2ccccc2c(=O)c2c1cccc2)SCc1nnn[nH]1

STK782162
Synonyms: 2-{[(4E)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylideneamino]oxy}-N-(4-methoxybenzyl)acetamide
Smiles: COc1ccc(cc1)CNC(=O)CO/N=C/1\CCCc2c1non2

STK782163
Synonyms: 2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}-N-[4-(piperidin-1-ylcarbonyl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N1CCCCC1)COc1nsnc1N1CCOCC1

STK782164
Synonyms: ethyl3-[({[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}acetyl)amino]benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)COc1nsnc1N1CCOCC1

STK782166
Synonyms: 2-(4-oxo-1-phenyl-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Cn1cnc2c(c1=O)cnn2c1ccccc1)Nc1ccc(cc1)OC(F)(F)F

STK686678
Synonyms: 2-[(3-nitro-4-oxo-4,5-dihydropyrazolo[1,5-a]pyrazin-6-yl)amino]benzoicacid
Smiles: [O-][N+](=O)c1cnn2c1c(=O)[nH]c(c2)Nc1ccccc1C(=O)O

STK782167
Synonyms: N-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-4-ethoxy-3-methylbenzenesulfonamide
Smiles: CCOc1ccc(cc1C)S(=O)(=O)NCCc1c(C)[nH]c2c1cccc2Cl

STK782168
Synonyms: 4-ethoxy-N-(2-oxo-1,2-dihydropyridin-3-yl)benzenesulfonamide
Smiles: CCOc1ccc(cc1)S(=O)(=O)Nc1ccc[nH]c1=O

STK782169
Synonyms: (3-bromophenyl)[4-(piperidin-1-ylsulfonyl)piperazin-1-yl]methanone
Smiles: Brc1cccc(c1)C(=O)N1CCN(CC1)S(=O)(=O)N1CCCCC1

STK782171
Synonyms: 1-{[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl}azepane
Smiles: Fc1ccc(cc1)N1CCN(CC1)S(=O)(=O)N1CCCCCC1

STK782172
Synonyms: 1-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}azepane
Smiles: Fc1ccccc1N1CCN(CC1)S(=O)(=O)N1CCCCCC1

STK782174
Synonyms: 1-{4-[3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-hydroxypropoxy]-3-methoxyphenyl}ethanone
Smiles: COc1cc(ccc1OCC(Cn1nc(c(c1C)Cl)C)O)C(=O)C

STK782176
Synonyms: 1-(naphthalen-2-yloxy)-3-[4-(piperidin-1-ylsulfonyl)piperazin-1-yl]propan-2-ol
Smiles: OC(CN1CCN(CC1)S(=O)(=O)N1CCCCC1)COc1ccc2c(c1)cccc2

STK782182
Synonyms: 3-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl}-6-methoxy-2H-chromen-2-one
Smiles: COc1ccc2c(c1)cc(c(=O)o2)C(=O)N1CCN(CC1)C(=O)c1ccco1

STK782184
Synonyms: 1-[(3-ethoxy-4-fluorophenyl)sulfonyl]-2-methyl-2,3-dihydro-1H-indole
Smiles: CCOc1cc(ccc1F)S(=O)(=O)N1C(C)Cc2c1cccc2

STK782191
Synonyms: 2,5-dichloro-N-[2-(trifluoromethyl)-1H-benzimidazol-7-yl]benzamide
Smiles: Clc1ccc(c(c1)C(=O)Nc1cccc2c1[nH]c(n2)C(F)(F)F)Cl

STK782192
Synonyms: N-(2-fluorophenyl)-2-{5-[4-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamide
Smiles: O=C(Nc1ccccc1F)Cn1nnc(n1)c1ccc(cc1)C(F)(F)F

STK782196
Synonyms: 5-(1,3-benzodioxol-5-yl)-2-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-2H-tetrazole
Smiles: Brc1cc2OCOc2cc1Cn1nnc(n1)c1ccc2c(c1)OCO2

STK686682
Synonyms: {4-[2-(4-fluorobenzyl)-2H-tetrazol-5-yl]phenoxy}aceticacid
Smiles: OC(=O)COc1ccc(cc1)c1nnn(n1)Cc1ccc(cc1)F

STK782201
Synonyms: 2-[5-(2-chlorophenyl)-2H-tetrazol-2-yl]-N-[4-(piperidin-1-ylcarbonyl)phenyl]acetamide
Smiles: O=C(Cn1nnc(n1)c1ccccc1Cl)Nc1ccc(cc1)C(=O)N1CCCCC1

STK782202
Synonyms: N-[2-(3,4-diethoxyphenyl)ethyl]-2-{5-[4-(trifluoromethyl)phenyl]-2H-tetrazol-2-yl}acetamide
Smiles: CCOc1cc(CCNC(=O)Cn2nnc(n2)c2ccc(cc2)C(F)(F)F)ccc1OCC

STK686685
Synonyms: N-(4-methoxybenzyl)-2-[2-(1,3-thiazol-5-yl)-1H-benzimidazol-1-yl]acetamide
Smiles: COc1ccc(cc1)CNC(=O)Cn1c(nc2c1cccc2)c1cncs1

STK686686
Synonyms: ({4-methyl-5-[(9-oxoacridin-10(9H)-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)aceticacid
Smiles: OC(=O)CSc1nnc(n1C)Cn1c2ccccc2c(=O)c2c1cccc2

STK686694
Synonyms: 6-bromo-4,5-dicyano-3,3-dimethyl-2-[(propan-2-ylideneamino)oxy]-1,2,3,4-tetrahydropyridine-4-carboxamide
Smiles: N#CC1(C(=O)N)C(=C(Br)NC(C1(C)C)ON=C(C)C)C#N

STK686695
Synonyms: (3E)-2-amino-4-(furan-3-yl)buta-1,3-diene-1,1,3-tricarbonitrile
Smiles: N#C/C(=C/c1cocc1)/C(=C(C#N)C#N)N

STK686696
Synonyms: [5-acetyl-3-cyano-4-(4-methoxyphenyl)-6-methyl-4,5-dihydropyridin-2(3H)-ylidene]propanedinitrile
Smiles: N#CC1C(=C(C#N)C#N)N=C(C(C1c1ccc(cc1)OC)C(=O)C)C

STK686699
Synonyms: 1-(1,3-benzothiazol-2-yl)-3-(1-phenylethyl)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1c1nc2c(s1)cccc2)C(c1ccccc1)C

STK686704
Synonyms: ethyl[(4E)-4-(hydroxyimino)-2,5-dimethylpiperidin-1-yl]acetate
Smiles: CC1C/C(=N\O)/C(CN1CC(=O)OCC)C