FULL DB

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

STK687379
Synonyms: 11,12-dihydroxy-4,8-bis(3-methylphenyl)-3,4,4a,5,6,7,7a,8-octahydrochromeno[3,2-i]quinazoline-2(1H)-thione
Smiles: Cc1cccc(c1)C1NC(=S)NC23C1CCCC3C(c1c(O2)c(O)c(O)cc1)c1cccc(c1)C

STK687380
Synonyms: 9-methyl-2-thioxo-1,2,3,4-tetrahydro-5H-6,1,3-benzoxadiazocin-5-one
Smiles: O=C1CNC(=S)Nc2c(O1)ccc(c2)C

STK687381
Synonyms: 1-cyclopropyl-6-fluoro-8-methoxy-7-[3-methyl-4-({4-methyl-3,5-bis[(propan-2-yloxy)carbonyl]thiophen-2-yl}carbamothioyl)piperazin-1-yl]-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: COc1c(N2CCN(C(C2)C)C(=S)Nc2sc(c(c2C(=O)OC(C)C)C)C(=O)OC(C)C)c(F)cc2c1n(cc(c2=O)C(=O)O)C1CC1

STK687383
Synonyms: N-(4-chlorophenyl)-2-(6-fluoro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetamide
Smiles: O=C(Cn1sc2c(c1=O)ccc(c2)F)Nc1ccc(cc1)Cl

STK687384
Synonyms: N-(4-bromophenyl)-2-(6-fluoro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetamide
Smiles: O=C(Cn1sc2c(c1=O)ccc(c2)F)Nc1ccc(cc1)Br

STK687385
Synonyms: N-benzyl-2-(6-fluoro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetamide
Smiles: O=C(Cn1sc2c(c1=O)ccc(c2)F)NCc1ccccc1

STK687386
Synonyms: N-(2,3-dichlorophenyl)-2-(6-fluoro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetamide
Smiles: O=C(Cn1sc2c(c1=O)ccc(c2)F)Nc1cccc(c1Cl)Cl

STK687387
Synonyms: 7,9-diiodo-2-[(4-methylphenyl)sulfonyl]-4-nitro-1,2-dihydro[1]benzoxepino[4,3,2-cd]indole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CC2=Cc3cc(I)cc(c3Oc3c2c1cc(c3)[N+](=O)[O-])I

STK687388
Synonyms: 7,9-diiodo-2-[(4-methylphenyl)sulfonyl]-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Smiles: Cc1ccc(cc1)S(=O)(=O)n1cc2c3c1cc(cc3Oc1c(C2)cc(I)cc1I)[N+](=O)[O-]

STK687389
Synonyms: 2-[5-(3-aminophenoxy)-3-nitro-1H-1,2,4-triazol-1-yl]acetamide
Smiles: NC(=O)Cn1nc(nc1Oc1cccc(c1)N)[N+](=O)[O-]

STK687390
Synonyms: 4-amino-N-{4-[chloro(difluoro)methoxy]phenyl}-5-(phenylcarbonyl)-1,2-oxazole-3-carboxamide
Smiles: O=C(c1noc(c1N)C(=O)c1ccccc1)Nc1ccc(cc1)OC(Cl)(F)F

STK687391
Synonyms: 4-acetyl-5-(4-chlorophenyl)-3-hydroxy-1-[2-(1H-imidazol-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Clc1ccc(cc1)C1N(CCc2c[nH]cn2)C(=O)C(=C1C(=O)C)O

STK687393
Synonyms: 4-[(4-fluorophenyl)carbonyl]-3-hydroxy-1-[2-(1H-imidazol-4-yl)ethyl]-5-(3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cccc(c1)C1N(CCc2c[nH]cn2)C(=O)C(=C1C(=O)c1ccc(cc1)F)O

STK687399
Synonyms: diethyl[1-(4-fluorophenyl)-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl]phosphoramidate
Smiles: CCOP(=O)(NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2c1ccc(cc1)F)C(F)(F)F)OCC

STK687400
Synonyms: 2-[3-(pyrazin-2-yl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]propanoicacid
Smiles: OC(=O)C(n1c(S)nnc1c1cnccn1)C

STK687402
Synonyms: 6-bromo-N-[3-(dimethylamino)propyl]-8-methoxy-2-oxo-2H-chromene-3-carboxamide
Smiles: COc1cc(Br)cc2c1oc(=O)c(c2)C(=O)NCCCN(C)C

STK687403
Synonyms: 2,4-dichloro-N-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]benzenesulfonamide
Smiles: Clc1ccc(c(c1)Cl)S(=O)(=O)NCCc1c(C)[nH]c2c1cc(F)cc2

STK687405
Synonyms: 2-(diethylamino)ethyl4-{[(6-bromo-8-methoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)NC(=O)c1cc2cc(Br)cc(c2oc1=O)OC)CC

STK687406
Synonyms: 1-(2-fluorobenzyl)-2,5'-dioxo-1'-phenyl-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2ccccc2)C2=C(C31c1ccccc1N(C3=O)Cc1ccccc1F)C(=O)CCC2

STK687407
Synonyms: ethyl4-[(dimethylamino)methyl]-5-hydroxy-1-(2-methoxy-2-oxoethyl)-2-methyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1c(CN(C)C)c(O)cc2)CC(=O)OC

STK687409
Synonyms: N-(biphenyl-4-ylmethyl)-2-(trifluoromethyl)-1H-benzimidazol-7-amine
Smiles: FC(c1nc2c([nH]1)c(ccc2)NCc1ccc(cc1)c1ccccc1)(F)F

STK687411
Synonyms: methyl(4-{[6-(5-methyl-2-oxoimidazolidin-4-yl)hexanoyl]amino}phenoxy)acetate
Smiles: COC(=O)COc1ccc(cc1)NC(=O)CCCCCC1NC(=O)NC1C

STK687414
Synonyms: ethyl4-[2-(4-bromophenyl)-2-oxo-1-phenylethyl]-5,5-dimethyl-2-oxotetrahydrofuran-3-carboxylate
Smiles: CCOC(=O)C1C(=O)OC(C1C(C(=O)c1ccc(cc1)Br)c1ccccc1)(C)C

STK687415
Synonyms: 1-{2-deoxy-3-O-[(3,4,5-trimethoxyphenyl)carbonyl]pentofuranosyl}-5-methylpyrimidine-2,4(1H,3H)-dione
Smiles: OCC1OC(CC1OC(=O)c1cc(OC)c(c(c1)OC)OC)n1cc(C)c(=O)[nH]c1=O

STK687418
Synonyms: 4,11-bis(methoxymethyl)-2,6,9-trimethylbispyrido[3',2':4,5]thieno[3,2-b:3',2'-d]pyridine
Smiles: COCc1cc(C)nc2c1c1nc(C)c3c(c1s2)c1c(COC)cc(nc1s3)C

STK687422
Synonyms: 4-[5-(4,4-diphenyl-1,4-dihydro-2H-3,1-benzoxazin-2-yl)furan-2-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)c1ccc(o1)C1Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1

STK687426
Synonyms: N-[2-{[3-amino-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-2-yl]carbonyl}-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-yl]benzamide
Smiles: COCc1cc(C)nc2c1c(NC(=O)c1ccccc1)c(s2)C(=O)c1sc2c(c1N)c(COC)cc(n2)C

STK687427
Synonyms: 1-(4-fluorophenyl)-5-(methoxymethyl)-7-methyl-2-(4-nitrophenyl)-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2c1ccc(cc1)F)c1ccc(cc1)[N+](=O)[O-]

STK687428
Synonyms: 2-(3,4-dichlorophenyl)-1-(4-fluorophenyl)-5-(methoxymethyl)-7-methyl-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2c1ccc(cc1)F)c1ccc(c(c1)Cl)Cl

STK687429
Synonyms: 2-[1-benzyl-5-(methoxymethyl)-7-methyl-4-oxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-2-yl]benzoicacid
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2Cc1ccccc1)c1ccccc1C(=O)O

STK687432
Synonyms: N-butyl-4-(hydroxymethyl)-6-methyl-2-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}pyridine-3-carboxamide
Smiles: CCCCNC(=O)c1c(CO)cc(nc1SCC(=O)Nc1ccccc1)C

STK687435
Synonyms: 2,6-dichloro-N-(2-cyano-4,5-diethoxyphenyl)-4-methylpyridine-3-carboxamide
Smiles: CCOc1cc(NC(=O)c2c(C)cc(nc2Cl)Cl)c(cc1OCC)C#N

STK687436
Synonyms: ethyl9-(4-methoxyphenyl)-7-methyl-4-oxo-3-(4-sulfamoylphenyl)-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazine-8-carboxylate
Smiles: CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)OC)c1nnn(c(=O)c1s2)c1ccc(cc1)S(=O)(=O)N

STK687437
Synonyms: ethyl9-(4-bromophenyl)-3-(4-chlorophenyl)-7-methyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazine-8-carboxylate
Smiles: CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)Br)c1nnn(c(=O)c1s2)c1ccc(cc1)Cl

STK687438
Synonyms: ethyl3,9-bis(4-chlorophenyl)-7-methyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazine-8-carboxylate
Smiles: CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)Cl)c1nnn(c(=O)c1s2)c1ccc(cc1)Cl

STK687439
Synonyms: ethyl9-(4-chlorophenyl)-3-(4-methoxyphenyl)-7-methyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazine-8-carboxylate
Smiles: CCOC(=O)c1c(C)nc2c(c1c1ccc(cc1)Cl)c1nnn(c(=O)c1s2)c1ccc(cc1)OC

STK687440
Synonyms: 8-[2-(3,4-diethoxyphenyl)ethyl]-1,3,6-trimethyl-7-(4-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: CCOc1cc(ccc1OCC)CCn1c2nc3c(n2c(c1c1ccc(cc1)C)C)c(=O)n(c(=O)n3C)C

STK687442
Synonyms: methyl4-[1,3,6-trimethyl-7-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]butanoate
Smiles: COC(=O)CCCn1c2nc3c(n2c(c1c1ccc(cc1)C)C)c(=O)n(c(=O)n3C)C

STK687443
Synonyms: 1'-(3-chloro-4-fluorophenyl)-2,5'-dioxo-1-(prop-2-en-1-yl)-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: C=CCN1c2ccccc2C2(C1=O)C(=C(n1cccc1)N(C1=C2C(=O)CCC1)c1ccc(c(c1)Cl)F)C#N

STK687445
Synonyms: 5-(morpholin-4-yl)-1,2,3,4-tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinoline-8-thiol
Smiles: Sc1nnnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK687447
Synonyms: 2-(2,3-dihydro-1,4-benzodioxin-2-yl)ethanamine
Smiles: NCCC1COc2c(O1)cccc2

STK687448
Synonyms: 2-[(4-carboxy-5-methylhexanoyl)amino]benzoicacid
Smiles: O=C(Nc1ccccc1C(=O)O)CCC(C(=O)O)C(C)C

STK687449
Synonyms: 2-[2-amino-4-(3-chlorophenyl)-3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1cccc(c1)Cl)C(=O)CCC2)c1sc2c(c1C#N)C1CCN2CC1

STK687450
Synonyms: 2-[2-amino-3-cyano-4-(3-nitrophenyl)-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CCC2)c1sc2c(c1C#N)C1CCN2CC1

STK687451
Synonyms: 2-{2-amino-3-cyano-4-[4-(methylsulfanyl)phenyl]-5-oxo-5,6,7,8-tetrahydroquinolin-1(4H)-yl}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carbonitrile
Smiles: CSc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CCC2)c1sc2c(c1C#N)C1CCN2CC1)C#N

STK687452
Synonyms: 2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1'-[2-(trifluoromethyl)phenyl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2ccccc2C(F)(F)F)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CCC2

STK687453
Synonyms: 1'-(3-chloro-2-methylphenyl)-7',7'-dimethyl-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2cccc(c2C)Cl)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CC(C2)(C)C

STK687454
Synonyms: 1'-(5-bromopyridin-2-yl)-7',7'-dimethyl-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2ccc(cn2)Br)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CC(C2)(C)C

STK687455
Synonyms: tert-butyl(1-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-1-oxopropan-2-yl)carbamate
Smiles: O=C(OC(C)(C)C)NC(C(=O)NCCc1nc2c([nH]1)cccc2)C

STK687457
Synonyms: N-(3-fluorophenyl)-1-[(4-methylphenyl)sulfanyl]-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Smiles: Cc1ccc(cc1)Sc1c(ccc2c1C(=O)c1c(C2=O)cccc1)C(=O)Nc1cccc(c1)F

STK687459
Synonyms: (5Z)-3-[2-(1H-benzimidazol-2-yl)ethyl]-2-phenyl-5-[4-(propan-2-yloxy)benzylidene]-3,5-dihydro-4H-imidazol-4-one
Smiles: CC(Oc1ccc(cc1)/C=C/1\N=C(N(C1=O)CCc1nc2c([nH]1)cccc2)c1ccccc1)C

STK687460
Synonyms: (5Z)-3-[2-(1H-benzimidazol-2-yl)ethyl]-5-(4-chlorobenzylidene)-2-(2-chlorophenyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: Clc1ccc(cc1)/C=C/1\N=C(N(C1=O)CCc1nc2c([nH]1)cccc2)c1ccccc1Cl

STK687461
Synonyms: (5Z)-3-[2-(1H-benzimidazol-2-yl)ethyl]-5-(4-bromobenzylidene)-2-(3-bromophenyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: Brc1ccc(cc1)/C=C/1\N=C(N(C1=O)CCc1nc2c([nH]1)cccc2)c1cccc(c1)Br

STK687462
Synonyms: (5Z)-3-[2-(1H-benzimidazol-2-yl)ethyl]-2-(3-bromophenyl)-5-(furan-2-ylmethylidene)-3,5-dihydro-4H-imidazol-4-one
Smiles: Brc1cccc(c1)C1=N/C(=C\c2ccco2)/C(=O)N1CCc1nc2c([nH]1)cccc2

STK687463
Synonyms: (5Z)-3-[2-(1H-benzimidazol-2-yl)ethyl]-5-(3,4-dimethoxybenzylidene)-2-(4-methoxyphenyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1)C1=N/C(=C\c2ccc(c(c2)OC)OC)/C(=O)N1CCc1nc2c([nH]1)cccc2

STK687464
Synonyms: (5Z)-3-[2-(1H-benzimidazol-2-yl)ethyl]-5-(4-methoxybenzylidene)-2-(4-methoxyphenyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1)C1=N/C(=C\c2ccc(cc2)OC)/C(=O)N1CCc1nc2c([nH]1)cccc2

STK687466
Synonyms: 2-{[(4E)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylideneamino]oxy}-1-(3,4-dihydroisoquinolin-2(1H)-yl)ethanone
Smiles: O=C(N1CCc2c(C1)cccc2)CO/N=C/1\CCCc2c1non2

STK687467
Synonyms: 5-amino-6-bromo-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-one
Smiles: CCn1c2cc(Br)c(cc2n(c1=O)CC)N

STK687475
Synonyms: 1-(4-bromophenyl)-N-(3-chlorophenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)Cl)c1ccc(cc1)Br

STK687479
Synonyms: 4-(4-chlorophenyl)-N-(2,3-dimethylphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: Clc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=S)Nc1cccc(c1C)C)c1ccccc1

STK687480
Synonyms: 2-[(3-methoxyphenyl)amino]-6-methylpyrimidin-4(3H)-one
Smiles: COc1cccc(c1)Nc1nc(C)cc(=O)[nH]1

STK687495
Synonyms: N-(3,4-dichlorophenyl)-1,4-bis(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccc(c(c1)Cl)Cl)c1ccc(cc1)OC

STK687516
Synonyms: 1,4-bis(4-bromophenyl)-N-(3-chlorophenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Brc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)Cl)c1ccc(cc1)Br

STK687546
Synonyms: 5,5'-[(4-methoxyphenyl)methanediyl]bis(4-phenyl-1,3-thiazol-2(3H)-one)
Smiles: COc1ccc(cc1)C(c1sc(=O)[nH]c1c1ccccc1)c1sc(=O)[nH]c1c1ccccc1

STK687547
Synonyms: 5,5'-[(4-methylphenyl)methanediyl]bis(4-phenyl-1,3-thiazol-2(3H)-one)
Smiles: Cc1ccc(cc1)C(c1sc(=O)[nH]c1c1ccccc1)c1sc(=O)[nH]c1c1ccccc1

STK687548
Synonyms: 5,5'-(thiophen-2-ylmethanediyl)bis(4-phenyl-1,3-thiazol-2(3H)-one)
Smiles: O=c1sc(c([nH]1)c1ccccc1)C(c1sc(=O)[nH]c1c1ccccc1)c1cccs1

STK687549
Synonyms: 3-benzyl-5-methyl-1-(2-phenoxyethyl)pyrimidine-2,4(1H,3H)-dione
Smiles: O=c1n(CCOc2ccccc2)cc(c(=O)n1Cc1ccccc1)C

STK687550
Synonyms: 3-benzyl-5-methyl-1-[2-(4-methylphenoxy)ethyl]pyrimidine-2,4(1H,3H)-dione
Smiles: Cc1ccc(cc1)OCCn1cc(C)c(=O)n(c1=O)Cc1ccccc1

STK687551
Synonyms: 2-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-N-[4-(pentyloxy)phenyl]acetamide
Smiles: CCCCCOc1ccc(cc1)NC(=O)COc1ccc(cc1n1nc2c(n1)cccc2)C

STK687552
Synonyms: N-{3-[(1,3-dioxo-2-phenyl-2,3-dihydro-1H-inden-2-yl)amino]-2,6-dimethylphenyl}acetamide
Smiles: CC(=O)Nc1c(C)ccc(c1C)NC1(c2ccccc2)C(=O)c2c(C1=O)cccc2

STK687553
Synonyms: 1-methyl-3-(methylsulfonyl)-5-phenyl-1H-1,2,4-triazole
Smiles: Cn1nc(nc1c1ccccc1)S(=O)(=O)C

STK687554
Synonyms: N-(propan-2-yl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
Smiles: CC(NC1=NCCCCC1)C

STK687555
Synonyms: 2-hydrazinyl-N-phenyl-2-thioxoacetamide
Smiles: NNC(=S)C(=O)Nc1ccccc1

STK687556
Synonyms: 2-methyl-7-nitro-9H-xanthen-9-one
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)ccc(c1)[N+](=O)[O-]

STK687559
Synonyms: 2'-(4-chlorophenyl)-7-(trifluoromethyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cccc2C(F)(F)F

STK687561
Synonyms: 8-amino-5-(2-chloro-6-fluorophenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1c(F)cccc1Cl)C(=O)CCC2)sc1c3C2CCN1CC2

STK687562
Synonyms: 8-amino-5-(5-bromo-2-fluorophenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cc(Br)ccc1F)C(=O)CCC2)sc1c3C2CCN1CC2

STK687563
Synonyms: 8-amino-5-(2,3-dimethoxyphenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccc(c1OC)OC)C(=O)CCC2)sc1c3C2CCN1CC2

STK687564
Synonyms: 8-amino-5-(3,4-dimethoxyphenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: COc1ccc(cc1OC)C1C2=C(CCCC2=O)n2c(=C1C#N)nc(c1c2sc2c1C1CCN2CC1)N

STK687565
Synonyms: 8-amino-5-(2,5-dimethoxyphenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cc(OC)ccc1OC)C(=O)CCC2)sc1c3C2CCN1CC2

STK687566
Synonyms: 8-amino-5-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cc(OC)c(c(c1)OC)O)C(=O)CCC2)sc1c3C2CCN1CC2

STK687567
Synonyms: 2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1'-[3-(trifluoromethyl)phenyl]-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2cccc(c2)C(F)(F)F)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CCC2

STK687568
Synonyms: 6-(4-fluorobenzyl)-4-{4-[(2-fluorobenzyl)oxy]phenyl}-3,4-dihydropyrido[3',2':5,6]pyrimido[1,2-a]benzimidazole-2,5(1H,6H)-dione
Smiles: O=C1CC(c2ccc(cc2)OCc2ccccc2F)c2c(N1)n1c3ccccc3nc1n(c2=O)Cc1ccc(cc1)F

STK687571
Synonyms: 8-amino-5-(4-fluorophenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1ccc(cc1)F)C(=O)CCC2)sc1c3C2CCN1CC2

STK687572
Synonyms: 8-amino-5-(3-bromophenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccc(c1)Br)C(=O)CCC2)sc1c3C2CCN1CC2

STK687575
Synonyms: 9-chloro-8-[(3-methylpiperidin-1-yl)sulfonyl]-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: CC1CCCN(C1)S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)cccc3

STK687578
Synonyms: 9-chloro-3-methyl-8-(piperidin-1-ylsulfonyl)-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: Cc1ccn2c(c1)nc(=O)c1c2cc(Cl)c(c1)S(=O)(=O)N1CCCCC1

STK687579
Synonyms: N-propan-2-yl-N-prop-2-yn-1-yl-beta-alanine
Smiles: C#CCN(C(C)C)CCC(=O)O

STK687580
Synonyms: 1,1'-(2,7-dimethylocta-3,5-diyne-2,7-diyl)bis(3-methylpiperidin-4-ol)
Smiles: OC1CCN(CC1C)C(C#CC#CC(N1CCC(C(C1)C)O)(C)C)(C)C

STK687582
Synonyms: 8-amino-5-(3-nitrophenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CCC2)sc1c3C2CCN1CC2

STK687583
Synonyms: 8-amino-4-oxo-5-[4-(trifluoromethyl)phenyl]-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1ccc(cc1)C(F)(F)F)C(=O)CCC2)sc1c3C2CCN1CC2

STK687584
Synonyms: 8-amino-5-[4-(methylsulfanyl)phenyl]-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: CSc1ccc(cc1)C1C2=C(CCCC2=O)n2c(=C1C#N)nc(c1c2sc2c1C1CCN2CC1)N

STK687585
Synonyms: 2-amino-1-(4-bromo-2-chlorophenyl)-7,7-dimethyl-4-(5-nitrothiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1ccc(s1)[N+](=O)[O-])C(=O)CC(C2)(C)C)c1ccc(cc1Cl)Br

STK687587
Synonyms: 9-chloro-3-methyl-8-[(4-methylpiperidin-1-yl)sulfonyl]-6H-pyrido[1,2-a]quinazolin-6-one
Smiles: CC1CCN(CC1)S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)ccc(c3)C

STK687588
Synonyms: 9-chloro-N,N-bis(2-methoxyethyl)-3-methyl-6-oxo-6H-pyrido[1,2-a]quinazoline-8-sulfonamide
Smiles: COCCN(S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)ccc(c3)C)CCOC

STK687589
Synonyms: 8-amino-4-oxo-5-(3,4,5-trimethoxyphenyl)-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: COc1c(OC)cc(cc1OC)C1C2=C(CCCC2=O)n2c(=C1C#N)nc(c1c2sc2c1C1CCN2CC1)N

STK687590
Synonyms: 8-amino-5-(1,3-benzodioxol-5-yl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1ccc4c(c1)OCO4)C(=O)CCC2)sc1c3C2CCN1CC2

STK687591
Synonyms: 8-amino-5-(4-nitrophenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)CCC2)sc1c3C2CCN1CC2

STK687592
Synonyms: 1-benzyl-1'-(3-chloro-4-fluorophenyl)-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2ccc(c(c2)Cl)F)C2=C(C31C(=O)N(c1c3cccc1)Cc1ccccc1)C(=O)CCC2

STK687593
Synonyms: N-[2-(3,4-diethoxyphenyl)ethyl]-7-(1H-tetrazol-1-yl)dibenzo[b,d]furan-2-sulfonamide
Smiles: CCOc1cc(CCNS(=O)(=O)c2ccc3c(c2)c2ccc(cc2o3)n2cnnn2)ccc1OCC

STK687594
Synonyms: 1'-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-5-methyl-5-nitrospiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: O=C1N(CN2CCC3(CC2)OCCO3)c2c(C31OCC(CO3)(C)[N+](=O)[O-])cccc2

STK687595
Synonyms: 4-[5-(1,3-benzodioxol-5-yloxy)-1H-tetrazol-1-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)n1nnnc1Oc1ccc2c(c1)OCO2

STK687597
Synonyms: 2-ethoxy-2-oxoethyl2-amino-4,6-dinitrobenzoate
Smiles: CCOC(=O)COC(=O)c1c(N)cc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK687598
Synonyms: 8-amino-N-[4-chloro-3-(trifluoromethyl)phenyl]-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)C(F)(F)F)Cl

STK687599
Synonyms: 2,2'-[(4-cyano-1,2-thiazole-3,5-diyl)disulfanediyl]bis[N-(2-chlorobenzyl)acetamide]
Smiles: N#Cc1c(SCC(=O)NCc2ccccc2Cl)nsc1SCC(=O)NCc1ccccc1Cl

STK687600
Synonyms: 2,2'-[(4-cyano-1,2-thiazole-3,5-diyl)disulfanediyl]bis[N-(2,4-difluorophenyl)acetamide]
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2F)F)nsc1SCC(=O)Nc1ccc(cc1F)F

STK687601
Synonyms: 3-[1-(4-methylpent-4-en-2-yn-1-yl)piperidin-2-yl]pyridine
Smiles: CC(=C)C#CCN1CCCCC1c1cccnc1

STK687602
Synonyms: 3-{1-[3-(cyclohex-1-en-1-yl)prop-2-yn-1-yl]piperidin-2-yl}pyridine
Smiles: C1CCC(=CC1)C#CCN1CCCCC1c1cccnc1

STK687603
Synonyms: 1-benzyl-3-({1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl}amino)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1Cc1ccccc1)NC1CCN(CC1)c1ncc(cc1Cl)C(F)(F)F

STK687604
Synonyms: 1-benzyl-4-(prop-2-en-1-yl)piperidin-4-ol
Smiles: C=CCC1(O)CCN(CC1)Cc1ccccc1

STK687605
Synonyms: 3-(1H-imidazol-1-yl)-1-phenylpropan-1-amine
Smiles: NC(c1ccccc1)CCn1cncc1

STK687606
Synonyms: 4-methyl-1-[2-(pyridin-3-yl)piperidin-1-yl]oct-7-en-2-yn-4-ol
Smiles: C=CCCC(C#CCN1CCCCC1c1cccnc1)(O)C

STK687607
Synonyms: 4-{4-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-5-methylthiophen-2-yl}-2-methyl-5-oxo-N-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: O=C1CCCC2=C1C(c1cc(c(s1)C)CSc1nc3c(s1)cccc3)C(=C(N2)C)C(=O)Nc1ccccc1

STK687608
Synonyms: 2-amino-4-{4-[(1,3-benzothiazol-2-ylsulfanyl)methyl]thiophen-2-yl}-1-(3-chlorophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1scc(c1)CSc1nc3c(s1)cccc3)C(=O)CCC2)c1cccc(c1)Cl

STK687609
Synonyms: 3-[1-(7-methyloct-2-yn-1-yl)piperidin-2-yl]pyridine
Smiles: CC(CCCC#CCN1CCCCC1c1cccnc1)C

STK687610
Synonyms: 4-hydroxy-4-methyl-7-[2-(pyridin-3-yl)piperidin-1-yl]hept-5-yn-2-one
Smiles: CC(=O)CC(C#CCN1CCCCC1c1cccnc1)(O)C

STK687611
Synonyms: 4-methyl-1,2,5-oxadiazole-3-carbonitrile
Smiles: Cc1nonc1C#N

STK687612
Synonyms: ethyl1-azabicyclo[2.2.2]octane-3-carboxylate
Smiles: CCOC(=O)C1CN2CCC1CC2

STK687615
Synonyms: (1S,2R,3aR)-2-(2-fluorophenyl)-1-[(4-fluorophenyl)carbonyl]-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@H]2C=Cc3c(N2[C@@H]([C@H]1c1ccccc1F)C(=O)c1ccc(cc1)F)cccc3

STK687617
Synonyms: 6-hydroxypyridine-3-carboxylicacid
Smiles: Oc1ccc(cn1)C(=O)O

STK687618
Synonyms: 4-methoxy-2,6-dinitrobenzoicacid
Smiles: COc1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C(=O)O

STK687624
Synonyms: 1-(4-methylpent-4-en-2-yn-1-yl)piperidine
Smiles: CC(=C)C#CCN1CCCCC1

STK687626
Synonyms: dibenzo[b,d]furan-2-sulfonylchloride
Smiles: ClS(=O)(=O)c1ccc2c(c1)c1ccccc1o2

STK687627
Synonyms: 4-(azepan-1-ylmethyl)-5-methylthiophene-2-carbaldehyde
Smiles: O=Cc1cc(c(s1)C)CN1CCCCCC1

STK687628
Synonyms: ethylhexahydrospiro[cyclohexane-1,3'-pyrrolizine]-1'-carboxylate
Smiles: CCOC(=O)C1CC2(N3C1CCC3)CCCCC2

STK687629
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-1-[(4-methylphenyl)sulfanyl]-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Smiles: Cc1ccc(cc1)Sc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)Nc1ccc(cc1)OC(Cl)(F)F

STK687630
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-1-[(4-chlorophenyl)sulfanyl]-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Smiles: Clc1ccc(cc1)Sc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)Nc1ccc(cc1)OC(Cl)(F)F

STK687633
Synonyms: 2,2,4,4-tetramethyl-5-(3-methylpent-4-en-1-yl)-1,3-dioxolane
Smiles: C=CC(CCC1OC(OC1(C)C)(C)C)C

STK687641
Synonyms: 1-chloro-4-(2,2-diphenylethenyl)benzene
Smiles: Clc1ccc(cc1)/C=C(\c1ccccc1)/c1ccccc1

STK687644
Synonyms: 1,3-dichloro-2-methoxy-5-nitrobenzene
Smiles: COc1c(Cl)cc(cc1Cl)[N+](=O)[O-]

STK687645
Synonyms: N,N-dimethyl-3-phenylpropan-1-amine
Smiles: CN(CCCc1ccccc1)C

STK687646
Synonyms: 2-(octylsulfanyl)ethylcarbamimidothioate
Smiles: CCCCCCCCSCCSC(=N)N

STK687647
Synonyms: 2-(decylsulfanyl)ethylcarbamimidothioate
Smiles: CCCCCCCCCCSCCSC(=N)N

STK687652
Synonyms: 2-(7-chloroheptyl)thiophene
Smiles: ClCCCCCCCc1cccs1

STK687653
Synonyms: 9-chloro-1-(thiophen-2-yl)nonan-1-one
Smiles: ClCCCCCCCCC(=O)c1cccs1

STK687655
Synonyms: 6-[5-(4-carboxybutyl)thiophen-2-yl]hexanoicacid
Smiles: OC(=O)CCCCCc1ccc(s1)CCCCC(=O)O

STK687656
Synonyms: 1-(ethenylsulfonyl)butane
Smiles: CCCCS(=O)(=O)C=C

STK687658
Synonyms: 2-(butylsulfanyl)ethylcarbamimidothioate
Smiles: CCCCSCCSC(=N)N

STK687659
Synonyms: 1,2-dichloro-1,1-dinitroethane
Smiles: ClCC([N+](=O)[O-])([N+](=O)[O-])Cl

STK687665
Synonyms: 1-methoxy-4-(phenylsulfonyl)benzene
Smiles: COc1ccc(cc1)S(=O)(=O)c1ccccc1

STK687669
Synonyms: N-methyl-N-(4-nitrophenyl)benzene-1,4-diamine
Smiles: Nc1ccc(cc1)N(c1ccc(cc1)[N+](=O)[O-])C

STK687672
Synonyms: 2-(butylsulfonyl)ethylcarbamimidothioate
Smiles: CCCCS(=O)(=O)CCSC(=N)N

STK687674
Synonyms: 4-(dodecylsulfanyl)-6-methylfuro[3,4-c]pyridin-3(1H)-one
Smiles: CCCCCCCCCCCCSc1nc(C)cc2c1C(=O)OC2

STK687678
Synonyms: N,N'-dicyclohexyl-6-(morpholin-4-yl)-1,3,5-triazine-2,4-diamine
Smiles: C1CCC(CC1)Nc1nc(NC2CCCCC2)nc(n1)N1CCOCC1

STK687680
Synonyms: (4E)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylideneazinicacid
Smiles: [O-]/[N+](=C\1/CCCc2c1non2)/O

STK687681
Synonyms: N'-(1H-benzimidazol-2-yl)-4-hydroxybenzohydrazide
Smiles: Oc1ccc(cc1)C(=O)NNc1nc2c([nH]1)cccc2

STK687682
Synonyms: 2-[(3-nitro-2-oxo-2H-chromen-4-yl)amino]benzamide
Smiles: NC(=O)c1ccccc1Nc1c2ccccc2oc(=O)c1[N+](=O)[O-]

STK687683
Synonyms: 1'-(2-methyl-5-nitrophenyl)-2,5'-dioxo-1-(prop-2-en-1-yl)-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: C=CCN1c2ccccc2C2(C1=O)C(=C(n1cccc1)N(C1=C2C(=O)CCC1)c1cc(ccc1C)[N+](=O)[O-])C#N

STK687684
Synonyms: ethyl2-({[7-(1H-tetrazol-1-yl)dibenzo[b,d]furan-2-yl]sulfonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1ccc2c(c1)c1ccc(cc1o2)n1cnnn1

STK687685
Synonyms: (3E)-3-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]-1-methyl-1,3-dihydro-2H-indol-2-one
Smiles: N=C1S/C(=C/2\c3ccccc3N(C2=O)C)/C(=O)N1c1nccs1

STK687686
Synonyms: 2-(diethylamino)ethyl4-{[3-oxo-3-(thiophen-2-yl)propyl]amino}benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)NCCC(=O)c1cccs1)CC

STK687688
Synonyms: 3-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)N1CCN(CC1)c1ccnc2c1ccc(c2)Cl

STK687690
Synonyms: 7-chloro-4-[4-(3-nitropyridin-2-yl)piperazin-1-yl]quinoline
Smiles: Clc1ccc2c(c1)nccc2N1CCN(CC1)c1ncccc1[N+](=O)[O-]

STK687692
Synonyms: 1-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-2-(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)ethanone
Smiles: Clc1c(C)nn(c1C)C(=O)Cn1nc(c(c1C)I)C

STK687693
Synonyms: methyl4-[({[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]carbonyl}amino)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)CNC(=O)c1onc(n1)c1ccc2c(c1)OCO2

STK687698
Synonyms: 5-benzyl-5'-methoxy-5H-spiro[benzimidazo[1,2-c]quinazoline-6,3'-indol]-2'(1'H)-one
Smiles: COc1ccc2c(c1)C1(C(=O)N2)N(Cc2ccccc2)c2ccccc2c2n1c1ccccc1n2

STK687700
Synonyms: 4-(4-{[2-(4-nitro-1H-pyrazol-1-yl)propanoyl]amino}-1H-pyrazol-1-yl)butanoicacid
Smiles: OC(=O)CCCn1ncc(c1)NC(=O)C(n1ncc(c1)[N+](=O)[O-])C

STK687703
Synonyms: N-(4-chlorophenyl)-5-methyl-7-[4-(trifluoromethyl)phenyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)C(F)(F)F)nnn2

STK687705
Synonyms: 1-(4-chlorophenyl)-4-{[(4-fluorophenyl)amino]methyl}-N-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Smiles: Fc1ccc(cc1)NCc1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1)c1ccc(cc1)Cl

STK687707
Synonyms: N-cyclohexyl-1-methyl-2-oxo-1-[(pentafluorophenyl)carbonyl]-1,7b-dihydrocyclopropa[c]chromene-1a(2H)-carboxamide
Smiles: Fc1c(F)c(c(c(c1F)F)F)C(=O)C1(C)C2C1(C(=O)NC1CCCCC1)C(=O)Oc1c2cccc1

STK687708
Synonyms: 1a-(morpholin-4-ylcarbonyl)-1a,7b-dihydro-2H-spiro[cyclopropa[c]chromene-1,2'-indene]-1',2(3'H)-dione
Smiles: O=C1Oc2ccccc2C2C1(C(=O)N1CCOCC1)C12Cc2c(C1=O)cccc2

STK687709
Synonyms: 2-{(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)[(3,4,5-trimethoxyphenyl)carbonyl]amino}ethyl3,4,5-trimethoxybenzoate
Smiles: COc1cc(cc(c1OC)OC)C(=O)OCCN(C(=O)c1cc(OC)c(c(c1)OC)OC)CC12CC3CC(C2)CC(C1)C3

STK687711
Synonyms: 2-{2-[4-(3,5-dichlorophenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]ethyl}phthalazin-1(2H)-one
Smiles: Clc1cc(Cl)cc(c1)n1c(nnc1S)CCn1ncc2c(c1=O)cccc2

STK687712
Synonyms: N-(4-methylphenyl)-2-({5-(pyridin-4-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc(n1c1cccc(c1)C(F)(F)F)c1ccncc1

STK687713
Synonyms: N-(2,5-dimethoxyphenyl)-2-(4-oxo-5,6,7,8,9,10-hexahydrocycloocta[4,5]thieno[2,3-d][1,2,3]triazin-3(4H)-yl)acetamide
Smiles: COc1ccc(c(c1)NC(=O)Cn1nnc2c(c1=O)c1CCCCCCc1s2)OC

STK687714
Synonyms: methyl2-({[(4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]acetyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2nc(C)cc(n2)O)sc2c1CCCCCC2

STK687715
Synonyms: methyl2-({[(4-hydroxy-5,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2nc(C)c(c(n2)O)C)sc2c1CCCCCC2

STK687716
Synonyms: 2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: C1CCc2c(C1)c1c(s2)ncn2c1nc(n2)C12CC3CC(C2)CC(C1)C3

STK687717
Synonyms: 2-(4-ethoxyphenyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CCOc1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK687718
Synonyms: methyl2-({[(5-ethyl-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]acetyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2nc(C)c(c(n2)O)CC)sc2c1CCCCCC2

STK687720
Synonyms: 2-{[4-amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethyl-6-nitrophenyl)acetamide
Smiles: COc1ccc(cc1OC)c1nnc(n1N)SCC(=O)Nc1c(C)cc(cc1[N+](=O)[O-])C

STK687721
Synonyms: 2-(quinolin-2-yl)-8,9,10,11,12,13-hexahydrocycloocta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: C1CCCc2c(CC1)c1c(s2)ncn2c1nc(n2)c1ccc2c(n1)cccc2

STK687722
Synonyms: 2-(5-cyclopropyl-1H-pyrazol-3-yl)-8,9,10,11,12,13-hexahydrocycloocta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: C1CCCc2c(CC1)c1c(s2)ncn2c1nc(n2)c1n[nH]c(c1)C1CC1

STK687723
Synonyms: 2-{[5-(5-chloro-2-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide
Smiles: COc1ccc(cc1c1nnc(n1c1ccccc1)SCC(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C)Cl

STK687724
Synonyms: methyl4-[({[5-methyl-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1C)C

STK687725
Synonyms: 2-[5-(4-fluorophenyl)-1H-pyrazol-3-yl]-8,9,10,11,12,13-hexahydrocycloocta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: Fc1ccc(cc1)c1[nH]nc(c1)c1nc2n(n1)cnc1c2c2CCCCCCc2s1

STK687726
Synonyms: 2-[5-(thiophen-3-yl)-1H-pyrazol-3-yl]-8,9,10,11,12,13-hexahydrocycloocta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: C1CCCc2c(CC1)c1c(s2)ncn2c1nc(n2)c1n[nH]c(c1)c1ccsc1

STK687727
Synonyms: 4-(3-chloro-4-fluorophenyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Smiles: Fc1ccc(cc1Cl)n1c(S)nnc1Cn1c(nc2c1cccc2)c1ccccn1

STK687728
Synonyms: 2-({5-[(2,4-dichlorophenoxy)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dimethoxyphenyl)acetamide
Smiles: COc1ccc(cc1NC(=O)CSc1nnc(n1c1ccccc1C)COc1ccc(cc1Cl)Cl)OC

STK687729
Synonyms: methyl2-{[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSC2=NCCS2)sc2c1CCCCCC2

STK687730
Synonyms: 2-chloro-5-[({[5-(pyridin-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(c(c1)C(=O)O)Cl)CSc1nnc(o1)c1cccnc1

STK687731
Synonyms: 2-chloro-4-{[({5-[(2,4-dichlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]amino}benzoicacid
Smiles: O=C(Nc1ccc(c(c1)Cl)C(=O)O)CSc1nnc(s1)COc1ccc(cc1Cl)Cl

STK687732
Synonyms: N-phenylethanimidamide
Smiles: CC(=N)Nc1ccccc1

STK687733
Synonyms: 2-(2-chlorophenyl)-3-{[(E)-(2-chlorophenyl)methylidene]amino}-1-(prop-2-yn-1-yl)-2,3-dihydroquinazolin-4(1H)-one
Smiles: C#CCN1c2ccccc2C(=O)N(C1c1ccccc1Cl)/N=C/c1ccccc1Cl

STK687736
Synonyms: 1,1-bis[4-(dimethylamino)phenyl]octadec-2-yn-1-ol
Smiles: CCCCCCCCCCCCCCCC#CC(c1ccc(cc1)N(C)C)(c1ccc(cc1)N(C)C)O

STK687737
Synonyms: 3-(2-chloro-4-methylphenyl)-2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]propanoicacid
Smiles: Cc1ccc(c(c1)Cl)CC(C(=O)O)Sc1[nH]c2c(n1)cc(cc2)C

STK687738
Synonyms: 9-chloro-5-[3-chloro-5-methoxy-4-(propan-2-yloxy)phenyl]-2-(4-chlorophenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1cc(cc(c1OC(C)C)Cl)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)Cl)Cl

STK687741
Synonyms: 3-[7-(methoxycarbonyl)-1,5-dinitro-3-azabicyclo[3.3.1]non-6-en-3-yl]propanoicacid
Smiles: COC(=O)C1=CC2(CC(C1)(CN(C2)CCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

STK687743
Synonyms: 3-(7-cyano-1,5-dinitro-3-azabicyclo[3.3.1]non-6-en-3-yl)propanoicacid
Smiles: N#CC1=CC2(CC(C1)(CN(C2)CCC(=O)O)[N+](=O)[O-])[N+](=O)[O-]

STK687744
Synonyms: N-[7,9-dichloro-2-(4-ethoxyphenyl)-5-oxo-5H-chromeno[4,3-d]pyrimidin-4-yl]propanamide
Smiles: CCOc1ccc(cc1)c1nc(NC(=O)CC)c2c(n1)c1cc(Cl)cc(c1oc2=O)Cl

STK687745
Synonyms: 3,3'-[(4-chlorophenyl)methanediyl]bis(1H-indole)
Smiles: Clc1ccc(cc1)C(c1c[nH]c2c1cccc2)c1c[nH]c2c1cccc2

STK687747
Synonyms: ethyl1-(furan-2-ylmethyl)-5-hydroxy-2-methyl-6-(3-nitrophenyl)-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(O)c(c2)c1cccc(c1)[N+](=O)[O-])Cc1ccco1

STK687750
Synonyms: 3-butyl-1,5-dinitro-3-azabicyclo[3.3.1]nonan-7-one
Smiles: CCCCN1CC2(CC(=O)CC(C1)(C2)[N+](=O)[O-])[N+](=O)[O-]

STK687751
Synonyms: methyl5-[(cyclohexylamino)methyl]-2-hydroxybenzoate
Smiles: COC(=O)c1cc(CNC2CCCCC2)ccc1O

STK687752
Synonyms: 5-chloro-3-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-1,3-benzoxazol-2(3H)-one
Smiles: Clc1ccc2c(c1)n(CC(=O)c1ccc(c(c1)O)O)c(=O)o2

STK687753
Synonyms: N-benzyl-6-bromo-1-[(4-chlorophenyl)carbonyl]-1-ethyl-2-oxo-1,7b-dihydrocyclopropa[c]chromene-1a(2H)-carboxamide
Smiles: CCC1(C(=O)c2ccc(cc2)Cl)C2C1(C(=O)NCc1ccccc1)C(=O)Oc1c2cc(Br)cc1

STK687755
Synonyms: (2E)-2-(8,8-dimethyl-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]isoquinolin-6(7H)-ylidene)ethanamide
Smiles: NC(=O)/C=C\1/NC(C)(C)Cc2c1cc1OCCOc1c2

STK687756
Synonyms: N-[9-(1,3-benzodioxol-5-yl)-7,7-dimethyl-1,4-dioxaspiro[4.5]dec-8-yl]benzamide
Smiles: O=C(c1ccccc1)NC1C(CC2(CC1(C)C)OCCO2)c1ccc2c(c1)OCO2

STK687757
Synonyms: N-(3-methoxypropyl)-3-methyl-4-oxo-3,4-dihydrophthalazine-1-carboxamide
Smiles: COCCCNC(=O)c1nn(C)c(=O)c2c1cccc2

STK687758
Synonyms: 4-(piperidin-1-yl)-6-[(triphenyl-lambda~5~-phosphanylidene)amino]-1,3,5-triazin-2-amine
Smiles: Nc1nc(nc(n1)N1CCCCC1)N=P(c1ccccc1)(c1ccccc1)c1ccccc1

STK687759
Synonyms: 2-[1-butyl-5-(methoxymethyl)-7-methyl-4-oxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-2-yl]benzoicacid
Smiles: CCCCN1c2nc(C)cc(c2C(=O)NC1c1ccccc1C(=O)O)COC

STK687760
Synonyms: N-(2,4-dichlorophenyl)-2-{[(1E)-1-{[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}-6-methyl-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl]sulfanyl}acetamide
Smiles: Cc1nc(SCC(=O)Nc2ccc(cc2Cl)Cl)c2c(c1)/C(=C\c1c[nH]nc1c1ccc(cc1)F)/OC2=O

STK687761
Synonyms: N-(6-cyano-1,3-benzodioxol-5-yl)-2-{[(1E)-1-{[3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}-6-methyl-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl]sulfanyl}acetamide
Smiles: N#Cc1cc2OCOc2cc1NC(=O)CSc1nc(C)cc2c1C(=O)O/C/2=C/c1c[nH]nc1c1ccc(cc1)F

STK687762
Synonyms: N-(2,4-dichlorophenyl)-2-{[(1E)-6-methyl-1-{[3-(3-nitrophenyl)-1H-pyrazol-4-yl]methylidene}-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl]sulfanyl}acetamide
Smiles: Cc1nc(SCC(=O)Nc2ccc(cc2Cl)Cl)c2c(c1)/C(=C\c1c[nH]nc1c1cccc(c1)[N+](=O)[O-])/OC2=O

STK687763
Synonyms: N-benzyl-4-(hydroxymethyl)-6-methyl-2-thioxo-1,2-dihydropyridine-3-carboxamide
Smiles: OCc1cc(C)[nH]c(=S)c1C(=O)NCc1ccccc1

STK687764
Synonyms: N-(2,4-dichlorophenyl)-2-({(1E)-1-[(5-methoxy-1H-indol-3-yl)methylidene]-6-methyl-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl}sulfanyl)acetamide
Smiles: COc1ccc2c(c1)c(c[nH]2)/C=C\1/OC(=O)c2c1cc(C)nc2SCC(=O)Nc1ccc(cc1Cl)Cl

STK687765
Synonyms: N-(6-cyano-1,3-benzodioxol-5-yl)-2-({(1E)-1-[(5-methoxy-1H-indol-3-yl)methylidene]-6-methyl-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl}sulfanyl)acetamide
Smiles: N#Cc1cc2OCOc2cc1NC(=O)CSc1nc(C)cc2c1C(=O)O/C/2=C/c1c[nH]c2c1cc(OC)cc2

STK687766
Synonyms: N-(2,4-dichlorophenyl)-2-{[(1E)-6-methyl-3-oxo-1-{[3-(thiophen-2-yl)-1H-pyrazol-4-yl]methylidene}-1,3-dihydrofuro[3,4-c]pyridin-4-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nc(C)cc2c1C(=O)O/C/2=C/c1c[nH]nc1c1cccs1

STK687769
Synonyms: 2-[{[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetyl}(methyl)amino]ethyl[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetate
Smiles: O=C(CSc1nn2c(n1)nc(cc2C)C)OCCN(C(=O)CSc1nn2c(n1)nc(cc2C)C)C

STK687770
Synonyms: 2-{[(3-amino-5-chloro-4,6-dimethylthieno[2,3-b]pyridin-2-yl)carbonyl](methyl)amino}ethyl3-amino-5-chloro-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate
Smiles: CN(C(=O)c1sc2c(c1N)c(C)c(c(n2)C)Cl)CCOC(=O)c1sc2c(c1N)c(C)c(c(n2)C)Cl

STK687771
Synonyms: 2-[{[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}(methyl)amino]ethyl[(3,5-dichloro-4,6-dimethylpyridin-2-yl)sulfanyl]acetate
Smiles: N#Cc1c(SCC(=O)N(CCOC(=O)CSc2nc(C)c(c(c2Cl)C)Cl)C)nc(c(c1C)Cl)C

STK687772
Synonyms: N-(2-{[(2E)-2-(5-bromo-2-hydroxybenzylidene)hydrazinyl]carbonyl}-4,6-dimethylthieno[2,3-b]pyridin-3-yl)-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1c(sc2c1c(C)cc(n2)C)C(=O)N/N=C/c1cc(Br)ccc1O

STK687773
Synonyms: N-(2-{[(2E)-2-(4-bromobenzylidene)hydrazinyl]carbonyl}-4,6-dimethylthieno[2,3-b]pyridin-3-yl)-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1c(sc2c1c(C)cc(n2)C)C(=O)N/N=C/c1ccc(cc1)Br

STK687774
Synonyms: 6-bromo-N-(1H-indazol-6-yl)-8-methoxy-2-oxo-2H-chromene-3-carboxamide
Smiles: COc1cc(Br)cc2c1oc(=O)c(c2)C(=O)Nc1ccc2c(c1)[nH]nc2

STK687775
Synonyms: [(1-propyl-1H-indol-3-yl)methyl]propanedioicacid
Smiles: CCCn1cc(c2c1cccc2)CC(C(=O)O)C(=O)O

STK687776
Synonyms: 1-(4-fluorobenzyl)-2,5'-dioxo-1'-phenyl-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(n2cccc2)N(c2ccccc2)C2=C(C31C(=O)N(c1c3cccc1)Cc1ccc(cc1)F)C(=O)CCC2

STK687777
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-7-(1H-tetrazol-1-yl)dibenzo[b,d]furan-2-sulfonamide
Smiles: Cc1c(NS(=O)(=O)c2ccc3c(c2)c2ccc(cc2o3)n2cnnn2)c(=O)n(n1C)c1ccccc1

STK687778
Synonyms: 2-bromo-4-nitropyridine1-oxide
Smiles: [O-][N+](=O)c1cc[n+](c(c1)Br)[O-]

STK687780
Synonyms: 2-chloro-N-[2-(4-hydroxyphenyl)-1-methylcyclohexyl]acetamide
Smiles: ClCC(=O)NC1(C)CCCCC1c1ccc(cc1)O

STK687782
Synonyms: 2-ethoxy-4-(furan-2-yl)-5,6-dihydronaphtho[2,1-j][1,7]phenanthroline-3-carbonitrile
Smiles: CCOc1nc2c3cc4c(nc3CCc2c(c1C#N)c1ccco1)ccc1c4cccc1

STK687783
Synonyms: ethyl5-hydroxy-2-methyl-7-(4-methyl-2-nitrophenyl)-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(O)cc2c1ccc(cc1[N+](=O)[O-])C

STK687784
Synonyms: ethyl3-amino-2-{3-[(Z)-2-(2,4-dimethylphenyl)-2-hydroxyethenyl]quinoxalin-2-yl}-3-oxopropanoate
Smiles: CCOC(=O)C(c1nc2ccccc2nc1/C=C(/c1ccc(cc1C)C)\O)C(=O)N

STK687785
Synonyms: 5,6-diphenyl-2,3-dihydropyrazine
Smiles: c1ccc(cc1)C1=NCCN=C1c1ccccc1

STK687786
Synonyms: N,N'-benzene-1,2-diylbis[5-(4-fluorophenyl)furan-2-carboxamide]
Smiles: O=C(c1ccc(o1)c1ccc(cc1)F)Nc1ccccc1NC(=O)c1ccc(o1)c1ccc(cc1)F

STK687787
Synonyms: N-(4,6-dimethyl[1,2]thiazolo[5,4-b]pyridin-3-yl)-4-methyl-N-[(4-methylphenyl)sulfonyl]benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)N(S(=O)(=O)c1ccc(cc1)C)c1nsc2c1c(C)cc(n2)C

STK687788
Synonyms: 5-(4-fluorophenyl)-3,5-dihydro-4H-1,2,3-triazole-4-thione
Smiles: S=C1NN=NC1c1ccc(cc1)F

STK687789
Synonyms: ethyl1-[(4-chlorophenyl)carbonyl]-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c]chromene-1a(2H)-carboxylate
Smiles: CCOC(=O)C12C(=O)Oc3c(C1C2(C)C(=O)c1ccc(cc1)Cl)cccc3

STK687790
Synonyms: 2-(methoxycarbonyl)phenyl4,5-dichloro-1,2-thiazole-3-carboxylate
Smiles: COC(=O)c1ccccc1OC(=O)c1nsc(c1Cl)Cl

STK687791
Synonyms: 2-methoxyethyl5-hydroxy-1-(4-methoxyphenyl)-2-methyl-1H-indole-3-carboxylate
Smiles: COCCOC(=O)c1c2cc(O)ccc2n(c1C)c1ccc(cc1)OC

STK687792
Synonyms: N-(1H-benzotriazol-4-yl)-2,4,6-trinitrobenzamide
Smiles: O=C(c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])Nc1cccc2c1nn[nH]2

STK687794
Synonyms: 2-(4-nitro-1H-pyrazol-3-yl)-1,2,3,4-oxatriazol-2-ium-5-olate
Smiles: [O-]c1nn[n+](o1)c1n[nH]cc1[N+](=O)[O-]

STK687796
Synonyms: 2-(1,3-benzothiazol-2-yl)-4-{(E)-[(3-methoxypropyl)imino]methyl}-5-propyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: COCCC/N=C/c1c(CCC)[nH]n(c1=O)c1nc2c(s1)cccc2

STK687797
Synonyms: (3E)-3-[3-(4-amino-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]-5-nitro-1,3-dihydro-2H-indol-2-one
Smiles: O=C1Nc2c(/C/1=C/1\SC(=N)N(C1=O)c1nonc1N)cc(cc2)[N+](=O)[O-]

STK687798
Synonyms: 8-amino-5-(3-methylphenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccc(c1)C)C(=O)CCC2)sc1c3C2CCN1CC2

STK687799
Synonyms: 8-amino-5-(3-methoxyphenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccc(c1)OC)C(=O)CCC2)sc1c3C2CCN1CC2

STK687800
Synonyms: 8-amino-5-(4-methoxyphenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: COc1ccc(cc1)C1C2=C(CCCC2=O)n2c(=C1C#N)nc(c1c2sc2c1C1CCN2CC1)N

STK687801
Synonyms: 8-amino-5-(4-hydroxy-3-methoxyphenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1ccc(c(c1)OC)O)C(=O)CCC2)sc1c3C2CCN1CC2

STK687804
Synonyms: 5-(4-chlorophenyl)-6-(3,4-dimethoxyphenyl)-7-(4-ethoxyphenyl)-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
Smiles: CCOc1ccc(cc1)N1C(=O)C2=C(C1c1ccc(c(c1)OC)OC)C(=NCCN2)c1ccc(cc1)Cl

STK687805
Synonyms: N-[1-(2,4-dichlorobenzyl)-1H-pyrazol-3-yl]-1,3-benzodioxole-5-carboxamide
Smiles: Clc1ccc(c(c1)Cl)Cn1ccc(n1)NC(=O)c1ccc2c(c1)OCO2

STK687810
Synonyms: 1,1'-{6-[4-(difluoromethoxy)phenyl]-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl}diethanone
Smiles: FC(Oc1ccc(cc1)c1c(sc2n(n1C(=O)C)cnn2)C(=O)C)F

STK687815
Synonyms: 3-amino-7-fluoro-6-(piperidin-1-yl)quinoxaline-2-carboxamide
Smiles: Fc1cc2nc(C(=O)N)c(nc2cc1N1CCCCC1)N

STK687825
Synonyms: (6S,6aR,13R,13aS)-N-methyl-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: CNC(=S)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31

STK687826
Synonyms: (6S,6aR,13R,13aS)-N-(2-fluorophenyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: S=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Nc1ccccc1F

STK687827
Synonyms: (1S,5R)-N-(3,5-dichlorophenyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: Clc1cc(cc(c1)Cl)NC(=S)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

STK687828
Synonyms: (5R)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: S=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Nc1ccc2c(c1)OCCO2

STK687831
Synonyms: 2,6-bis(morpholin-4-ylmethyl)-3,7-diphenyltetrahydro-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole-1,5-dithione
Smiles: S=C1N(CN2CCOCC2)C(N2N1C(c1ccccc1)N(C2=S)CN1CCOCC1)c1ccccc1

STK687833
Synonyms: 4-(dimethylamino)-N-propylbenzenecarbothioamide
Smiles: CCCNC(=S)c1ccc(cc1)N(C)C

STK687834
Synonyms: (2Z)-3-(morpholin-4-yl)-3-oxo-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanenitrile
Smiles: N#C/C(=C\1/C(=O)Nc2c1cccc2)/C(=O)N1CCOCC1

STK687835
Synonyms: 2-[(6-chloro-1,3-benzoxazol-2-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone
Smiles: Clc1ccc2c(c1)oc(n2)SCC(=O)N1CCN(CC1)c1ccccc1

STK687837
Synonyms: 2-[(4-bromobenzyl)sulfanyl]-6-chloro-1,3-benzoxazole
Smiles: Brc1ccc(cc1)CSc1nc2c(o1)cc(cc2)Cl

STK687838
Synonyms: 5-(4-methoxybenzyl)-6-methyl-2-(morpholin-4-yl)pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)Cc1c(C)nc([nH]c1=O)N1CCOCC1

STK687839
Synonyms: 1-[2-(4-chlorophenoxy)ethyl]-3-(1-phenylethyl)pyrimidine-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1)OCCn1ccc(=O)n(c1=O)C(c1ccccc1)C

STK687840
Synonyms: methyl4-[3-acetyl-1-(2-ethylhexyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
Smiles: CCCCC(CN1C(c2ccc(cc2)C(=O)OC)C(=C(C1=O)O)C(=O)C)CC

STK687841
Synonyms: 4-acetyl-1-(2-ethylhexyl)-3-hydroxy-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(c2ccccc2)C(=C(C1=O)O)C(=O)C)CC

STK687843
Synonyms: 4-acetyl-1-(2-ethylhexyl)-5-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(c2ccc(cc2)F)C(=C(C1=O)O)C(=O)C)CC

STK687844
Synonyms: 4-acetyl-1-(2-ethylhexyl)-5-(2-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(=O)C(=C(C1c1ccccc1F)C(=O)C)O)CC

STK687845
Synonyms: 4-acetyl-1-(2-ethylhexyl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(c2ccc(c(c2)OC)O)C(=C(C1=O)O)C(=O)C)CC

STK687846
Synonyms: 4-acetyl-1-(2-ethylhexyl)-3-hydroxy-5-(4-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(c2ccc(cc2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)C)CC

STK687847
Synonyms: 4-acetyl-1-(2-ethylhexyl)-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)C)CC

STK687848
Synonyms: 4-acetyl-1-(2-ethylhexyl)-3-hydroxy-5-(2-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)C)O)CC

STK687849
Synonyms: 4-acetyl-5-(4-bromophenyl)-1-(2-ethylhexyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(c2ccc(cc2)Br)C(=C(C1=O)O)C(=O)C)CC

STK687851
Synonyms: 5-(4-ethoxyphenyl)-4-[(4-fluorophenyl)carbonyl]-3-hydroxy-1-{2-[(2-hydroxyethyl)amino]ethyl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: OCCNCCN1C(c2ccc(cc2)OCC)C(=C(C1=O)O)C(=O)c1ccc(cc1)F

STK687852
Synonyms: N-(2,5-dimethoxyphenyl)-3-(3,4-dimethoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-6-amine
Smiles: COc1ccc(c(c1)NC1=Nn2c(SC1)nnc2c1ccc(c(c1)OC)OC)OC

STK687853
Synonyms: (1S,5R)-N-(3-chloro-4-fluorophenyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: S=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Nc1ccc(c(c1)Cl)F

STK687854
Synonyms: (5S)-8-oxo-N-(quinolin-6-yl)-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: S=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Nc1ccc2c(c1)cccn2

STK687856
Synonyms: 3-(piperidin-1-yl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)propanamide
Smiles: O=C(NC12CC3CC(C2)CC(C1)C3)CCN1CCCCC1

STK687857
Synonyms: 3,5-di-tert-butyl-N-{5-[2-(diethylamino)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Smiles: CCN(CCc1nnc(s1)NC(=O)c1cc(cc(c1)C(C)(C)C)C(C)(C)C)CC

STK687858
Synonyms: 3,5-di-tert-butyl-N-{5-[2-(piperidin-1-yl)ethyl]-1,3,4-thiadiazol-2-yl}benzamide
Smiles: O=C(c1cc(cc(c1)C(C)(C)C)C(C)(C)C)Nc1nnc(s1)CCN1CCCCC1

STK687859
Synonyms: 3-(4-tert-butylphenyl)-3-[(4-fluorophenyl)amino]-1-(4-methylphenyl)propan-1-one
Smiles: Cc1ccc(cc1)C(=O)CC(c1ccc(cc1)C(C)(C)C)Nc1ccc(cc1)F

STK687861
Synonyms: 3-(3,5-dimethoxyphenyl)-6-[(E)-2-(4-methylphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1cc(OC)cc(c1)c1nnc2n1nc(s2)/C=C/c1ccc(cc1)C

STK687862
Synonyms: 3-(3,5-dimethoxyphenyl)-6-(4-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1cc(OC)cc(c1)c1nnc2n1nc(s2)c1ccc(cc1)[N+](=O)[O-]

STK687863
Synonyms: 4-(4-ethoxy-2-nitrophenyl)-5-(3-phenyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Smiles: CCOc1ccc(c(c1)[N+](=O)[O-])n1c(S)nnc1c1[nH]nc(c1)c1ccccc1

STK687864
Synonyms: dimethylN-{[(5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}aspartate
Smiles: COC(=O)CC(C(=O)OC)NC(=S)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

STK687867
Synonyms: N-(1,3-benzothiazol-2-yl)-2-chloro-5-[(2,6-dimethylmorpholin-4-yl)sulfonyl]benzamide
Smiles: CC1OC(C)CN(C1)S(=O)(=O)c1ccc(c(c1)C(=O)Nc1nc2c(s1)cccc2)Cl

STK687868
Synonyms: 2,4-dichloro-5-(3,4-dihydroisoquinolin-2(1H)-ylsulfonyl)-N-(1,3-thiazol-2-yl)benzamide
Smiles: Clc1cc(Cl)c(cc1S(=O)(=O)N1CCc2c(C1)cccc2)C(=O)Nc1nccs1

STK687884
Synonyms: 4-acetyl-5-(2,4-dimethoxyphenyl)-1-(2-ethylhexyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(=O)C(=C(C1c1ccc(cc1OC)OC)C(=O)C)O)CC

STK687885
Synonyms: 4-acetyl-5-(2,5-dimethoxyphenyl)-1-(2-ethylhexyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(=O)C(=C(C1c1cc(OC)ccc1OC)C(=O)C)O)CC

STK687886
Synonyms: 4-acetyl-5-(2-chlorophenyl)-1-(2-ethylhexyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(=O)C(=C(C1c1ccccc1Cl)C(=O)C)O)CC

STK687888
Synonyms: 8,10-diamino-7-(4-chlorophenyl)-7H-benzo[7,8]chromeno[2,3-b]pyridine-9-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1N)C(c1ccc(cc1)Cl)c1c(O2)c2ccccc2cc1

STK687889
Synonyms: 8,10-diamino-7-(2-chlorophenyl)-7H-benzo[7,8]chromeno[2,3-b]pyridine-9-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1N)C(c1ccccc1Cl)c1c(O2)c2ccccc2cc1

STK687890
Synonyms: N-[3-(diethylamino)propyl]-4-hydroxy-3-methoxybenzenecarbothioamide
Smiles: CCN(CCCNC(=S)c1ccc(c(c1)OC)O)CC

STK687891
Synonyms: N-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-2-(9H-[1,2,4]triazolo[4,3-a]benzimidazol-3-ylsulfanyl)acetamide
Smiles: O=C(Nc1onc(n1)c1ccc(cc1)C)CSc1nnc2n1c1ccccc1[nH]2

STK687892
Synonyms: 5-(2,5-dimethylbenzyl)-6-methyl-2-(morpholin-4-yl)pyrimidin-4(3H)-one
Smiles: Cc1nc([nH]c(=O)c1Cc1cc(C)ccc1C)N1CCOCC1

STK687893
Synonyms: methyl2-[({[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: C=CCn1c(SCC(=O)Nc2sc3c(c2C(=O)OC)CCCCCC3)nnc1c1cccnc1

STK687894
Synonyms: 5-(3-phenyl-1H-pyrazol-5-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1c1cccc(c1)C(F)(F)F)c1[nH]nc(c1)c1ccccc1

STK687895
Synonyms: (6S,6aR,13R,13aS)-N-(4-chlorophenyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: Clc1ccc(cc1)NC(=S)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31

STK687896
Synonyms: (6R,6aR,13R,13aS)-N-[2-chloro-5-(trifluoromethyl)phenyl]-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: S=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Nc1cc(ccc1Cl)C(F)(F)F

STK687897
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-1-(3-chlorophenyl)-7,7-dimethyl-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Smiles: Clc1cccc(c1)n1c2CC(C)(C)CC(=O)c2cc(c1=O)C(=O)Nc1ccc(cc1)OC(Cl)(F)F

STK687900
Synonyms: N-[2-(1H-indol-3-yl)ethyl]-3-[4-(1H-pyrrol-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)c1ccc(cc1)n1cccc1)NCCc1c[nH]c2c1cccc2

STK687906
Synonyms: (6R,6aR,13R,13aS)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: S=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Nc1ccc2c(c1)OCCO2

STK687908
Synonyms: 4-bromo-3-(morpholin-4-ylsulfonyl)-5-nitrobenzoicacid
Smiles: [O-][N+](=O)c1cc(cc(c1Br)S(=O)(=O)N1CCOCC1)C(=O)O

STK687910
Synonyms: 2-(aziridin-1-yl)-3-(butylamino)naphthalene-1,4-dione
Smiles: CCCCNC1=C(N2CC2)C(=O)c2c(C1=O)cccc2

STK687911
Synonyms: 2-(aziridin-1-yl)-3-[(2-methylpropyl)amino]naphthalene-1,4-dione
Smiles: CC(CNC1=C(N2CC2)C(=O)c2c(C1=O)cccc2)C

STK687914
Synonyms: 2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-N-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)ethyl]benzamide
Smiles: Cc1ccc(c(c1)OCc1ccccc1C(=O)NCCOC12CC3CC(C2)CC(C1)C3)C(C)C

STK687915
Synonyms: 2'-phenyl-1-(prop-2-en-1-yl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: C=CCN1c2ccccc2C2(C1=O)N1CCCC1C1C2C(=O)N(C1=O)c1ccccc1

STK687916
Synonyms: 3-benzyl-7-(4-benzylpiperazin-1-yl)-5-methyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: Cc1nc(N2CCN(CC2)Cc2ccccc2)c2c(n1)n(Cc1ccccc1)c(=S)s2

STK687921
Synonyms: 3-benzyl-1'-(4-methoxyphenyl)-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)Cc1ccccc1)[N+](=O)[O-]

STK687922
Synonyms: 1-benzyl-2'-(4-chlorophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Smiles: Clc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)N(c2c1cccc2)Cc1ccccc1

STK687925
Synonyms: N-[1-(bicyclo[2.2.1]hept-2-yl)ethyl]-3-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Smiles: CC(C1CC2CC1CC2)NC(=O)c1onc(n1)Cn1ccc(n1)[N+](=O)[O-]

STK687926
Synonyms: N-(1,2-dihydroacenaphthylen-5-yl)-1-methyl-3-propyl-1H-pyrazole-5-carboxamide
Smiles: CCCc1cc(n(n1)C)C(=O)Nc1ccc2c3c1cccc3CC2

STK687929
Synonyms: N-{4-[5-(2-fluorobenzyl)-1,2,4-oxadiazol-3-yl]phenyl}-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1ncc(c1)[N+](=O)[O-])Nc1ccc(cc1)c1noc(n1)Cc1ccccc1F

STK687930
Synonyms: N-(4-{5-[(4-iodo-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)-2-(4-nitro-1H-pyrazol-1-yl)acetamide
Smiles: O=C(Cn1ncc(c1)[N+](=O)[O-])Nc1ccc(cc1)c1noc(n1)Cn1ncc(c1)I

STK687932
Synonyms: (3,4-dichlorophenyl)(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-yl)methanol
Smiles: OC(C12CN3CN(C2)CN(C1)C3)c1ccc(c(c1)Cl)Cl

STK687934
Synonyms: 3-[(2-phenoxyethyl)sulfanyl]-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Smiles: c1ccc(cc1)OCCSc1nnc2n1nc[nH]2

STK687938
Synonyms: diethyl(2E)-2-[(2-phenyl-1H-indol-5-yl)amino]but-2-enedioate
Smiles: CCOC(=O)/C(=C\C(=O)OCC)/Nc1ccc2c(c1)cc([nH]2)c1ccccc1

STK687943
Synonyms: methyl4-[(2,3-dichlorophenyl)amino]-4-oxo-3-(pyrrolidin-1-yl)butanoate
Smiles: COC(=O)CC(C(=O)Nc1cccc(c1Cl)Cl)N1CCCC1

STK687945
Synonyms: 4-[5-(pyrrolidin-1-ylmethyl)-1H-1,2,3-triazol-1-yl]-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1n1nncc1CN1CCCC1

STK687947
Synonyms: 4-nitrophenyl3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(4-methoxyphenyl)propanoate
Smiles: COc1ccc(cc1)C(N1C(=O)c2c(C1=O)cccc2)CC(=O)Oc1ccc(cc1)[N+](=O)[O-]

STK687950
Synonyms: 4-{2-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-2H-tetrazol-5-yl}pyridine
Smiles: Brc1cc2OCOc2cc1Cn1nnc(n1)c1ccncc1

STK687954
Synonyms: 2-(2-methyl-5-nitro-1H-imidazol-1-yl)-N-[4-(2H-tetrazol-5-ylmethyl)phenyl]acetamide
Smiles: O=C(Cn1c(C)ncc1[N+](=O)[O-])Nc1ccc(cc1)Cc1n[nH]nn1

STK687955
Synonyms: ethyl6-({(1,3-benzodioxol-5-ylmethyl)[(3-fluorophenyl)carbonyl]amino}methyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(C(=O)c1cccc(c1)F)Cc1ccc2c(c1)OCO2

STK687956
Synonyms: ethyl6-({(1,3-benzodioxol-5-ylmethyl)[(4-methoxyphenyl)carbonyl]amino}methyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(C(=O)c1ccc(cc1)OC)Cc1ccc2c(c1)OCO2

STK687957
Synonyms: ethyl6-{[(1,3-benzodioxol-5-ylmethyl){[4-(trifluoromethyl)phenyl]carbonyl}amino]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(C(=O)c1ccc(cc1)C(F)(F)F)Cc1ccc2c(c1)OCO2

STK687958
Synonyms: ethyl6-{[(1,3-benzodioxol-5-ylmethyl)(pyridin-4-ylcarbonyl)amino]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(C(=O)c1ccncc1)Cc1ccc2c(c1)OCO2

STK687959
Synonyms: ethyl7-amino-6-cyanopyrazolo[1,5-a]pyrimidine-3-carboxylate
Smiles: CCOC(=O)c1cnn2c1ncc(c2N)C#N

STK687963
Synonyms: 6-methyl-3-(phenylcarbonyl)[1,2]oxazolo[4,3-d]pyrimidin-7(6H)-one
Smiles: O=C(c1onc2c1ncn(c2=O)C)c1ccccc1

STK687964
Synonyms: 5-(3-fluorophenyl)-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Smiles: Fc1cccc(c1)c1onc(n1)c1ccc(cc1)C(F)(F)F

STK687966
Synonyms: 4-({[2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)quinazoline
Smiles: c1ccc2c(c1)c(ncn2)SCc1csc(n1)C12CC3CC(C2)CC(C1)C3

STK687970
Synonyms: ethyl6-{[(1,3-benzodioxol-5-ylmethyl)(phenylsulfonyl)amino]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(S(=O)(=O)c1ccccc1)Cc1ccc2c(c1)OCO2

STK687971
Synonyms: ethyl6-{[(1,3-benzodioxol-5-ylmethyl)(pyridin-3-ylcarbonyl)amino]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(C(=O)c1cccnc1)Cc1ccc2c(c1)OCO2

STK687972
Synonyms: 4,5-bis(2,5-dimethylthiophen-3-yl)-1,3-dihydro-2H-imidazol-2-one
Smiles: Cc1sc(cc1c1[nH]c(=O)[nH]c1c1cc(sc1C)C)C

STK687973
Synonyms: 8-amino-5-(3-fluorophenyl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccc(c1)F)C(=O)CCC2)sc1c3C2CCN1CC2

STK687975
Synonyms: 4-(3-nitrophenyl)-3-phenyl-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Smiles: O=C1CC(c2cccc(c2)[N+](=O)[O-])c2c(O1)[nH]nc2c1ccccc1

STK687976
Synonyms: (5R)-N-(2-fluorophenyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: S=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Nc1ccccc1F

STK687977
Synonyms: (1S,5R)-N-(1,3-benzodioxol-5-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: S=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Nc1ccc2c(c1)OCO2

STK687978
Synonyms: methylN-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}alaninate
Smiles: COC(=O)C(NC(=S)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C

STK687980
Synonyms: 2-(diethylamino)ethyl4-{[3-(1,3-benzodioxol-5-yl)-3-oxopropyl]amino}benzoate
Smiles: CCN(CCOC(=O)c1ccc(cc1)NCCC(=O)c1ccc2c(c1)OCO2)CC

STK687983
Synonyms: N,N-diethyl-N'-(3-methoxy-2,6-dinitrophenyl)ethane-1,2-diamine
Smiles: CCN(CCNc1c(ccc(c1[N+](=O)[O-])OC)[N+](=O)[O-])CC

STK687984
Synonyms: N'-(4-chloro-2,6-dinitrophenyl)-N,N-diethylethane-1,2-diamine
Smiles: CCN(CCNc1c(cc(cc1[N+](=O)[O-])Cl)[N+](=O)[O-])CC

STK687985
Synonyms: 4-chloro-2,6-dinitrophenylmethylether
Smiles: COc1c(cc(cc1[N+](=O)[O-])Cl)[N+](=O)[O-]

STK687988
Synonyms: ethyl5,5-dimethyl-2-oxo-4-(1-oxo-2,3-dihydro-1H-inden-2-yl)tetrahydrofuran-3-carboxylate
Smiles: CCOC(=O)C1C(=O)OC(C1C1Cc2c(C1=O)cccc2)(C)C

STK687991
Synonyms: ethyl6-{[(1,3-benzodioxol-5-ylmethyl)(pyrazin-2-ylcarbonyl)amino]methyl}-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(C(=O)c1cnccn1)Cc1ccc2c(c1)OCO2

STK687994
Synonyms: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,2,5-oxadiazol-3-yl]acetamide
Smiles: O=C(Nc1nonc1N1C(=O)c2c(C1=O)cccc2)CSc1nc2c(o1)cccc2

STK687996
Synonyms: 4-{[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)propyl]amino}-1-oxaspiro[4.5]dec-3-en-2-one
Smiles: CCC(C12CC3CC(C2)CC(C1)C3)NC1=CC(=O)OC21CCCCC2

STK687999
Synonyms: 4-{4-[(3-methylbenzyl)oxy]phenyl}-3,4-dihydro-2H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-2,5(1H)-dione
Smiles: O=C1CC(c2ccc(cc2)OCc2cccc(c2)C)c2c(N1)n1ccsc1nc2=O

STK688000
Synonyms: 8-amino-5-(2,5-dimethylthiophen-3-yl)-4-oxo-1,3,4,5,10,11-hexahydro-2H,9H-9,12-ethanopyrido[3'',2'':4',5']thieno[3',2':5,6]pyrimido[1,2-a]quinoline-6-carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cc(sc1C)C)C(=O)CCC2)sc1c3C2CCN1CC2

STK688001
Synonyms: 4-(3-fluorophenyl)-3-(3-nitrophenyl)-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Smiles: O=C1CC(c2cccc(c2)F)c2c(O1)[nH]nc2c1cccc(c1)[N+](=O)[O-]

STK688002
Synonyms: 4-(4-hydroxy-3-methoxyphenyl)-3-(4-methoxyphenyl)-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Smiles: COc1ccc(cc1)c1n[nH]c2c1C(CC(=O)O2)c1ccc(c(c1)OC)O

STK688003
Synonyms: 4-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-3-(4-methoxyphenyl)-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Smiles: COc1cc(ccc1OCc1ccccc1F)C1CC(=O)Oc2c1c(n[nH]2)c1ccc(cc1)OC

STK688006
Synonyms: 4-(quinoxalin-2-yl)benzene-1,2,3-triol
Smiles: Oc1ccc(c(c1O)O)c1cnc2c(n1)cccc2

STK688007
Synonyms: 7,8-difluoro-1,2-dihydro-3H-pyrazolo[4,3-c]quinolin-3-one
Smiles: Fc1cc2ncc3c(c2cc1F)[nH][nH]c3=O

STK688013
Synonyms: N-(2-{[(4-ethoxyphenyl)carbonyl]amino}ethyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole-5-carboxamide
Smiles: CCOc1ccc(cc1)C(=O)NCCNC(=O)c1onc(n1)c1cccs1

STK688014
Synonyms: 3-{[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylidene]amino}-2-butyl-9-(methoxymethyl)-7-methylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CCCCc1nc2c3c(COC)cc(nc3sc2c(=O)n1/N=C/c1cc2OCOc2cc1Br)C

STK688015
Synonyms: ethyl4-(methoxymethyl)-6-methyl-3-{[(4-nitrophenyl)carbonyl]amino}thieno[2,3-b]pyridine-2-carboxylate
Smiles: COCc1cc(C)nc2c1c(NC(=O)c1ccc(cc1)[N+](=O)[O-])c(s2)C(=O)OCC

STK688017
Synonyms: N-[4-(methoxymethyl)-6-methyl-2-(phenylcarbonyl)thieno[2,3-b]pyridin-3-yl]-4-nitrobenzamide
Smiles: COCc1cc(C)nc2c1c(NC(=O)c1ccc(cc1)[N+](=O)[O-])c(s2)C(=O)c1ccccc1

STK688018
Synonyms: 1-benzyl-2-(6-bromo-1,3-benzodioxol-5-yl)-5-(methoxymethyl)-7-methyl-2,3-dihydropyrido[2,3-d]pyrimidin-4(1H)-one
Smiles: COCc1cc(C)nc2c1C(=O)NC(N2Cc1ccccc1)c1cc2OCOc2cc1Br

STK688028
Synonyms: 4-(4-fluorophenyl)-3-(4-methylphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: Cc1ccc(cc1)c1n[nH]c2c1C(NC2=O)c1ccc(cc1)F

STK688031
Synonyms: 3-[5-(4-chlorophenyl)-8-oxo-6-(pyridin-2-yl)-2,3,6,8-tetrahydropyrrolo[3,4-e][1,4]diazepin-7(1H)-yl]benzoicacid
Smiles: Clc1ccc(cc1)C1=NCCNC2=C1C(c1ccccn1)N(C2=O)c1cccc(c1)C(=O)O

STK688032
Synonyms: ethyl6-({(1,3-benzodioxol-5-ylmethyl)[(4-fluorophenyl)sulfonyl]amino}methyl)-4-(4-methoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1ccc(cc1)OC)CN(S(=O)(=O)c1ccc(cc1)F)Cc1ccc2c(c1)OCO2

STK688033
Synonyms: 3-cyclopentyl-8-methyl-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)C1CCCC1

STK688035
Synonyms: 3-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-N-{2-[(thiophen-2-ylcarbonyl)amino]ethyl}-1,2,4-oxadiazole-5-carboxamide
Smiles: O=C(c1onc(n1)Cn1nc(cc1C)[N+](=O)[O-])NCCNC(=O)c1cccs1

STK688042
Synonyms: 1',5,5',7-tetramethylspiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indol]-2'(1'H)-one
Smiles: Cc1ccc2c(c1)C1(N3CC4(CN1CC(C3)(C4)C)C)C(=O)N2C

STK688044
Synonyms: N-(3,4-dimethoxybenzyl)-2-[2,2-dimethyl-4-(propan-2-yl)tetrahydro-2H-pyran-4-yl]ethanamine
Smiles: COc1cc(CNCCC2(CCOC(C2)(C)C)C(C)C)ccc1OC

STK688046
Synonyms: N-(4-fluorophenyl)-2-[4-(morpholin-4-ylsulfonyl)piperazin-1-yl]acetamide
Smiles: O=C(Nc1ccc(cc1)F)CN1CCN(CC1)S(=O)(=O)N1CCOCC1

STK688047
Synonyms: N-(4-methoxyphenyl)-2-[4-(piperidin-1-ylsulfonyl)piperazin-1-yl]acetamide
Smiles: COc1ccc(cc1)NC(=O)CN1CCN(CC1)S(=O)(=O)N1CCCCC1

STK688048
Synonyms: N-(4-methoxyphenyl)-2-[4-(morpholin-4-ylsulfonyl)piperazin-1-yl]acetamide
Smiles: COc1ccc(cc1)NC(=O)CN1CCN(CC1)S(=O)(=O)N1CCOCC1

STK688052
Synonyms: N-{1-[4-(1H-imidazol-1-yl)phenyl]ethyl}-4-iodobenzenesulfonamide
Smiles: Ic1ccc(cc1)S(=O)(=O)NC(c1ccc(cc1)n1cncc1)C

STK688053
Synonyms: 1-{1-[(4-fluorophenyl)sulfonyl]-3,5-dimethyl-1H-pyrazol-4-yl}ethanone
Smiles: Fc1ccc(cc1)S(=O)(=O)n1nc(c(c1C)C(=O)C)C

STK688054
Synonyms: 5-ethyl-N-(1H-indazol-7-yl)-2-methoxybenzenesulfonamide
Smiles: CCc1ccc(c(c1)S(=O)(=O)Nc1cccc2c1[nH]nc2)OC

STK688055
Synonyms: 7-amino-8H-9-thia-1,2,3,6,9b-pentaazabenzo[cd]azulen-4-ol
Smiles: NC1=Nc2cc(O)nc3n2c(SC1)nn3

STK688062
Synonyms: methyl2-{[(4H-1,2,4-triazol-3-ylsulfanyl)acetyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2[nH]cnn2)sc2c1CCCCCC2

STK688063
Synonyms: (3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)(4-fluorophenyl)acetonitrile
Smiles: N#CC(N1N=C(CC1c1ccccc1)c1ccccc1)c1ccc(cc1)F

STK688066
Synonyms: 1-(1,3-benzodioxol-5-yl)-3-(4-ethylphenyl)-3-[(4-fluorophenyl)amino]propan-1-one
Smiles: CCc1ccc(cc1)C(CC(=O)c1ccc2c(c1)OCO2)Nc1ccc(cc1)F

STK688067
Synonyms: 3-[2-(furan-2-yl)-2-oxoethyl]-3-hydroxy-1-(4-nitrobenzyl)-1,3-dihydro-2H-indol-2-one
Smiles: O=C(c1ccco1)CC1(O)c2ccccc2N(C1=O)Cc1ccc(cc1)[N+](=O)[O-]

STK688068
Synonyms: N-[2-(cyclohex-1-en-1-yl)ethyl]quinoxaline-2-carboxamide
Smiles: O=C(c1cnc2c(n1)cccc2)NCCC1=CCCCC1

STK688070
Synonyms: 1-{[3-(methylsulfanyl)-1H-1,2,4-triazol-5-yl]methyl}-4-phenylpyrrolidin-2-one
Smiles: CSc1nc([nH]n1)CN1CC(CC1=O)c1ccccc1

STK688071
Synonyms: 4-phenyl-1-[(3-sulfanyl-1H-1,2,4-triazol-5-yl)methyl]pyrrolidin-2-one
Smiles: O=C1CC(CN1Cc1[nH]nc(n1)S)c1ccccc1

STK688072
Synonyms: 1-benzyl-2-{[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]sulfanyl}-1H-benzimidazole
Smiles: c1ccc(cc1)Cn1c(SCc2onc(n2)c2ccccc2)nc2c1cccc2

STK688073
Synonyms: 1-benzyl-2-({[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-1H-benzimidazole
Smiles: Cc1ccc(cc1)c1noc(n1)CSc1nc2c(n1Cc1ccccc1)cccc2

STK688074
Synonyms: 1-benzyl-2-({[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-1H-benzimidazole
Smiles: Clc1ccc(cc1)c1noc(n1)CSc1nc2c(n1Cc1ccccc1)cccc2

STK688075
Synonyms: 12-oxo-12H-[1,3]benzothiazolo[2,3-b]quinazoline-8,9-dicarbonitrile
Smiles: N#Cc1cc2c(cc1C#N)sc1n2c(=O)c2c(n1)cccc2

STK688076
Synonyms: N'-(4,5-dicyano-2-nitrophenyl)-N'-(4-fluorobenzyl)benzohydrazide
Smiles: N#Cc1cc(N(NC(=O)c2ccccc2)Cc2ccc(cc2)F)c(cc1C#N)[N+](=O)[O-]

STK688077
Synonyms: N'-(3,4-dichlorobenzyl)-N'-(4,5-dicyano-2-nitrophenyl)benzohydrazide
Smiles: N#Cc1cc([N+](=O)[O-])c(cc1C#N)N(NC(=O)c1ccccc1)Cc1ccc(c(c1)Cl)Cl

STK688078
Synonyms: 7-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]hexahydro-2H-3,5-methanocyclopenta[b]furan-2-one
Smiles: COc1cccc(c1)c1noc(n1)C1C2CC3C(C1C(=O)O3)C2

STK688080
Synonyms: (1S,5R)-N-(bicyclo[2.2.1]hept-5-en-2-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: S=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)NC1CC2CC1C=C2

STK688081
Synonyms: (1S,5R)-8-oxo-N-(1-phenylethyl)-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: CC(c1ccccc1)NC(=S)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

STK688082
Synonyms: (1S,5R)-8-oxo-N-(4-sulfamoylphenyl)-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Smiles: S=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Nc1ccc(cc1)S(=O)(=O)N

STK688083
Synonyms: (6S,6aR,13R,13aS)-N-phenyl-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: S=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Nc1ccccc1

STK688084
Synonyms: (6S,6aR,13R,13aS)-N-(2-methylphenyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: S=C(N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31)Nc1ccccc1C

STK688085
Synonyms: (6S,6aR,13R,13aS)-N-(4-methylphenyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: Cc1ccc(cc1)NC(=S)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31

STK688086
Synonyms: (6aR,13R,13aS)-N-(4-methoxyphenyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: COc1ccc(cc1)NC(=S)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31

STK688087
Synonyms: (6S,6aR,13R,13aS)-N-(4-ethoxyphenyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: CCOc1ccc(cc1)NC(=S)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31

STK688088
Synonyms: (6S,6aR,13R,13aS)-N-(3,5-dichlorophenyl)-3,4,6,7,8,9,10,12,13,13a-decahydro-2H-6,13-methanodipyrido[1,2-a:3',2'-e]azocine-1(6aH)-carbothioamide
Smiles: Clc1cc(cc(c1)Cl)NC(=S)N1CCCC2=C[C@@H]3C[C@H]([C@H]12)CN1CCCC[C@H]31

STK688090
Synonyms: 5,6-dimethyl-2-sulfanylthieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Sc1nc2sc(c(c2c(=O)[nH]1)C)C

STK688091
Synonyms: 4-(2-methylphenyl)-5-{[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]methyl}-4H-1,2,4-triazole-3-thiol
Smiles: Cc1ccccc1n1c(S)nnc1Cn1c(nc2c1cccc2)c1ccccn1

STK688092
Synonyms: ethyl2-(4-cyano-5-{[(E)-ethoxymethylidene]amino}-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCO/C=N/c1c(C#N)cnn1c1nc(c(s1)C(=O)OCC)C

STK688093
Synonyms: N-(4-acetylphenyl)-2-{[5-(4-methylphenyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C(=O)C)CSc1nc2scc(c2c(=O)[nH]1)c1ccc(cc1)C

STK688094
Synonyms: methyl4-({[(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCCC3

STK688095
Synonyms: N-(2,5-dimethoxyphenyl)-2-[(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Smiles: COc1ccc(c(c1)NC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCCC3)OC

STK688096
Synonyms: N'-{2-[(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}thiophene-2-carbohydrazide
Smiles: O=C(CSc1[nH]c(=O)c2c(n1)sc(c2C)C)NNC(=O)c1cccs1

STK688097
Synonyms: 2-(2-phenylquinolin-4-yl)[1,2,4]triazolo[1,5-c]quinazoline
Smiles: c1ccc(cc1)c1nc2ccccc2c(c1)c1nc2n(n1)cnc1c2cccc1

STK688098
Synonyms: (1-ethyl-3-methyl-1H-pyrazol-4-yl)(3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)acetonitrile
Smiles: N#CC(c1cn(nc1C)CC)N1CCC(=N1)c1ccccc1

STK688099
Synonyms: 3-(3-methoxyphenyl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cccc(c1)c1noc(n1)C(=O)NC1CC(C)(C)NC(C1)(C)C

STK688101
Synonyms: (4R,4aR,5S,8R)-2-amino-4-(3-methoxyphenyl)-10-methyl-4,4a,5,6,7,8-hexahydro-3H-5,8-epiminobenzo[7]annulene-1,3,3-tricarbonitrile
Smiles: N#CC1=C(N)C([C@H]([C@@H]2C1=CC1CC[C@H]2N1C)c1cccc(c1)OC)(C#N)C#N

STK688106
Synonyms: 3-(thiophen-2-yl)-N-(2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}ethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1c(OC)cc(cc1OC)C(=O)NCCNC(=O)c1onc(n1)c1cccs1

STK688109
Synonyms: 1-[4-amino-2-(ethylamino)-1,3-thiazol-5-yl]ethanone
Smiles: CCNc1nc(c(s1)C(=O)C)N

STK688110
Synonyms: (8S,8aR,11aS,11bS)-8-[(4-fluorophenyl)carbonyl]-8,8a,11a,11b-tetrahydro-9H,11H-furo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11-dione
Smiles: O=C1OC(=O)[C@H]2[C@@H]1[C@@H](C(=O)c1ccc(cc1)F)N1[C@@H]2c2ccccc2C=C1

STK688112
Synonyms: N-(4,5-dicyano-2-nitrophenyl)valine
Smiles: N#Cc1cc(NC(C(=O)O)C(C)C)c(cc1C#N)[N+](=O)[O-]

STK688115
Synonyms: 3-(5-bromofuran-2-yl)-5-(4-nitrobenzyl)-1,2,4-oxadiazole
Smiles: Brc1ccc(o1)c1noc(n1)Cc1ccc(cc1)[N+](=O)[O-]

STK688119
Synonyms: 2-(4-nitro-1H-pyrazol-1-yl)-N-(4-{5-[(3-nitro-1H-pyrazol-1-yl)methyl]-1,2,4-oxadiazol-3-yl}phenyl)acetamide
Smiles: O=C(Cn1ncc(c1)[N+](=O)[O-])Nc1ccc(cc1)c1noc(n1)Cn1ccc(n1)[N+](=O)[O-]

STK688124
Synonyms: 2-[4-(pentafluoroethyl)-6-(trifluoromethyl)pyrimidin-2-yl]phenol
Smiles: Oc1ccccc1c1nc(cc(n1)C(C(F)(F)F)(F)F)C(F)(F)F

STK688125
Synonyms: 3-[6-amino-5-cyano-4-(4-methoxyphenyl)-3-methylpyrano[2,3-c]pyrazol-1(4H)-yl]benzoicacid
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)OC)c(C)nn2c1cccc(c1)C(=O)O

STK688127
Synonyms: 2-tert-butyl-6-(2-hydroxyethyl)tetrahydro-5H-2,3,4a,6,7a-pentaazacyclopenta[cd]indene-1,4(2H,3H)-dione
Smiles: OCCN1CN2C(=O)NC3C2N(C1)C(=O)N3C(C)(C)C

STK688129
Synonyms: ethyl(diphenylphosphoryl)(triphenyl-lambda~5~-phosphanylidene)acetate
Smiles: CCOC(=O)C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)P(=O)(c1ccccc1)c1ccccc1

STK688130
Synonyms: N'-[(E)-(4-fluoro-3-nitrophenyl)methylidene]pyridine-2-carbohydrazide
Smiles: O=C(c1ccccn1)N/N=C/c1ccc(c(c1)[N+](=O)[O-])F

STK688132
Synonyms: (1S,2S,5R)-2-{5-[4-(trifluoromethyl)phenyl]-1H-tetrazol-1-yl}-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: O=C1C[C@@H]([C@@H]2O[C@H]1OC2)n1nnnc1c1ccc(cc1)C(F)(F)F

STK688133
Synonyms: 3-(propan-2-yloxy)-5-(propan-2-ylsulfanyl)-1,2-thiazole-4-carbonitrile
Smiles: N#Cc1c(nsc1SC(C)C)OC(C)C

STK688138
Synonyms: 3-methyl-6-[2-(pyridin-3-yl)piperidin-1-yl]hex-4-yn-3-ylacetate
Smiles: CCC(OC(=O)C)(C#CCN1CCCCC1c1cccnc1)C

STK688139
Synonyms: 2-phenyl-5-[2-(pyridin-3-yl)piperidin-1-yl]pent-3-yn-2-ol
Smiles: CC(c1ccccc1)(C#CCN1CCCCC1c1cccnc1)O

STK688140
Synonyms: 2-cyclopropyl-5-[2-(pyridin-3-yl)piperidin-1-yl]pent-3-yn-2-ol
Smiles: CC(C1CC1)(C#CCN1CCCCC1c1cccnc1)O

STK688141
Synonyms: N-(3,5-dichlorophenyl)-1-[(4-methylphenyl)sulfanyl]-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Smiles: Cc1ccc(cc1)Sc1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)Nc1cc(Cl)cc(c1)Cl

STK688142
Synonyms: 1-[(4-chlorophenyl)sulfanyl]-9,10-dioxo-N-[3-(trifluoromethyl)phenyl]-9,10-dihydroanthracene-2-carboxamide
Smiles: Clc1ccc(cc1)Sc1c(ccc2c1C(=O)c1c(C2=O)cccc1)C(=O)Nc1cccc(c1)C(F)(F)F

STK688144
Synonyms: 2-(bicyclo[2.2.1]hept-5-en-2-yl)-5-[2-(pyridin-3-yl)piperidin-1-yl]pent-3-yn-2-ol
Smiles: CC(C1CC2CC1C=C2)(C#CCN1CCCCC1c1cccnc1)O

STK688147
Synonyms: 3-(chloromethyl)-1,2-oxazole
Smiles: ClCc1ccon1

STK688148
Synonyms: 2-hydroxy-3-nitrobenzoicacid
Smiles: OC(=O)c1cccc(c1O)[N+](=O)[O-]

STK688149
Synonyms: 9-methoxy-5,9-dimethyl-2-[2-(pyridin-3-yl)piperidin-1-yl]dec-3-yn-5-ol
Smiles: COC(CCCC(C#CC(N1CCCCC1c1cccnc1)C)(O)C)(C)C

STK688150
Synonyms: ethyl6-[2-(pyridin-3-yl)piperidin-1-yl]hex-4-ynoate
Smiles: CCOC(=O)CCC#CCN1CCCCC1c1cccnc1

STK688151
Synonyms: 3-[(triphenyl-lambda~5~-phosphanylidene)amino]-1,2-benzothiazole1,1-dioxide
Smiles: O=S1(=O)N=C(c2c1cccc2)N=P(c1ccccc1)(c1ccccc1)c1ccccc1

STK688152
Synonyms: [(2-fluorophenyl)imino](triphenyl)-lambda~5~-phosphane
Smiles: Fc1ccccc1N=P(c1ccccc1)(c1ccccc1)c1ccccc1

STK688153
Synonyms: [(2,6-dichlorophenyl)imino](triphenyl)-lambda~5~-phosphane
Smiles: Clc1cccc(c1N=P(c1ccccc1)(c1ccccc1)c1ccccc1)Cl

STK688155
Synonyms: [(2,4-dimethylphenyl)imino](triphenyl)-lambda~5~-phosphane
Smiles: Cc1ccc(c(c1)C)N=P(c1ccccc1)(c1ccccc1)c1ccccc1

STK688156
Synonyms: N-[diphenyl(pyridin-4-ylamino)-lambda~5~-phosphanylidene]benzamide
Smiles: O=C(c1ccccc1)N=P(c1ccccc1)(c1ccccc1)Nc1ccncc1

STK688157
Synonyms: N-[(diphenylphosphoryl)(4-nitrophenyl)methyl]-6-methylpyridin-2-amine
Smiles: Cc1cccc(n1)NC(P(=O)(c1ccccc1)c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

STK688158
Synonyms: N-[(diphenylphosphoryl)(furan-2-yl)methyl]-3-methylpyridin-2-amine
Smiles: Cc1cccnc1NC(P(=O)(c1ccccc1)c1ccccc1)c1ccco1

STK688159
Synonyms: 2-[(2E)-2-(1,7,7-trimethylbicyclo[2.2.1]hept-2-ylidene)hydrazinyl]-1,3-benzothiazole
Smiles: CC1(C)C2CCC1(C)/C(=N/Nc1nc3c(s1)cccc3)/C2

STK688161
Synonyms: N''-(diphenylphosphoryl)-N,N,N',N'-tetraethyl-P-phenylphosphonimidicdiamide
Smiles: CCN(P(=NP(=O)(c1ccccc1)c1ccccc1)(c1ccccc1)N(CC)CC)CC

STK688162
Synonyms: [(3-chloro-2-methylphenyl)imino](triphenyl)-lambda~5~-phosphane
Smiles: Cc1c(Cl)cccc1N=P(c1ccccc1)(c1ccccc1)c1ccccc1

STK688163
Synonyms: diphenyl[diphenyl(pyrimidin-2-ylamino)-lambda~5~-phosphanylidene]phosphoramidate
Smiles: O=P(N=P(c1ccccc1)(c1ccccc1)Nc1ncccn1)(Oc1ccccc1)Oc1ccccc1

STK688164
Synonyms: N'-(4,6-dimethylpyrimidin-2-yl)-P,P-diphenyl-N-pyrimidin-2-ylphosphinimidicamide
Smiles: Cc1cc(C)nc(n1)N=P(c1ccccc1)(c1ccccc1)Nc1ncccn1

STK688167
Synonyms: 3-ethyl-6-[2-(pyridin-3-yl)piperidin-1-yl]hex-4-yn-3-ol
Smiles: CCC(C#CCN1CCCCC1c1cccnc1)(CC)O

STK688168
Synonyms: 3-(4-fluorophenyl)-N-(2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}ethyl)-1,2,4-oxadiazole-5-carboxamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NCCNC(=O)c1onc(n1)c1ccc(cc1)F

STK688169
Synonyms: 2-amino-N'-[(E)-phenyl(pyridin-2-yl)methylidene]benzohydrazide
Smiles: O=C(c1ccccc1N)N/N=C(/c1ccccn1)\c1ccccc1

STK688174
Synonyms: 3,5-dimethyl-4-nitro-1H-pyrrole-2-carboxylicacid
Smiles: [O-][N+](=O)c1c(C)[nH]c(c1C)C(=O)O

STK688180
Synonyms: 3-(5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)propanoicacid
Smiles: OC(=O)CCc1n[nH]c(=S)[nH]1

STK688184
Synonyms: 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-[4-(1H-pyrrol-1-yl)benzyl]propanamide
Smiles: O=C(C(n1nc(c(c1C)[N+](=O)[O-])C)C)NCc1ccc(cc1)n1cccc1

STK688185
Synonyms: 2-(4-methyl-2-nitrophenoxy)-N-[4-(1H-pyrrol-1-yl)benzyl]acetamide
Smiles: O=C(COc1ccc(cc1[N+](=O)[O-])C)NCc1ccc(cc1)n1cccc1

STK688189
Synonyms: 3-[(2-phenoxyethyl)sulfanyl]-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-amine
Smiles: Nn1cnn2c1nnc2SCCOc1ccccc1

STK688197
Synonyms: 2-methyl-1-phenyl-5-[2-(pyridin-3-yl)piperidin-1-yl]pent-3-yn-2-ylacetate
Smiles: CC(=O)OC(Cc1ccccc1)(C#CCN1CCCCC1c1cccnc1)C

STK688200
Synonyms: 4-[benzyl(2-hydroxyethyl)amino]-1-oxaspiro[4.5]dec-3-en-2-one
Smiles: OCCN(C1=CC(=O)OC21CCCCC2)Cc1ccccc1

STK688206
Synonyms: N'-[(furan-2-ylcarbonyl)oxy]-4-[methyl(phenyl)amino]-6-(morpholin-4-yl)-1,3,5-triazine-2-carboximidamide
Smiles: CN(c1nc(nc(n1)N1CCOCC1)/C(=N\OC(=O)c1ccco1)/N)c1ccccc1

STK688207
Synonyms: ethyl2-{4-(dimethylamino)-6-[methyl(phenyl)amino]-1,3,5-triazin-2-yl}-1,2-dihydro-1,2,3,4-tetrazine-5-carboxylate
Smiles: CCOC(=O)c1c[nH]n(nn1)c1nc(nc(n1)N(c1ccccc1)C)N(C)C

STK688208
Synonyms: 1-(1-{4-[benzyl(methyl)amino]-6-(1H-pyrrol-1-yl)-1,3,5-triazin-2-yl}-5-methyl-1H-1,2,3-triazol-4-yl)ethanone
Smiles: CN(c1nc(nc(n1)n1cccc1)n1nnc(c1C)C(=O)C)Cc1ccccc1

STK688211
Synonyms: N,N,N'-trimethyl-N'-phenyl-6-[(triphenyl-lambda~5~-phosphanylidene)amino]-1,3,5-triazine-2,4-diamine
Smiles: CN(c1nc(nc(n1)N(C)C)N=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1

STK688213
Synonyms: 5,7-dimethyltetrazolo[1,5-a]pyridine-8-carbonitrile
Smiles: N#Cc1c(C)cc(n2c1nnn2)C

STK688219
Synonyms: 3-amino-4,6-dimethyl-N-(2-methyl-6-nitrophenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: Cc1cc(C)c2c(n1)sc(c2N)C(=O)Nc1c(C)cccc1[N+](=O)[O-]

STK688223
Synonyms: 2-methoxy-N-[4-(methoxymethyl)-6-methyl-2-(phenylcarbonyl)thieno[2,3-b]pyridin-3-yl]benzamide
Smiles: COCc1cc(C)nc2c1c(NC(=O)c1ccccc1OC)c(s2)C(=O)c1ccccc1

STK688224
Synonyms: N-{2-[hydroxy(phenyl)methyl]-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-yl}-2-methoxybenzamide
Smiles: COCc1cc(C)nc2c1c(NC(=O)c1ccccc1OC)c(s2)C(c1ccccc1)O

STK688225
Synonyms: N-[4,6-dimethyl-2-(phenylcarbonyl)thieno[2,3-b]pyridin-3-yl]-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1c(sc2c1c(C)cc(n2)C)C(=O)c1ccccc1

STK688226
Synonyms: N-{2-[hydroxy(phenyl)methyl]-4,6-dimethylthieno[2,3-b]pyridin-3-yl}-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1c(sc2c1c(C)cc(n2)C)C(c1ccccc1)O

STK688228
Synonyms: N-[4-(methoxymethyl)-6-methyl-2-(phenylcarbonyl)thieno[2,3-b]pyridin-3-yl]pentanamide
Smiles: CCCCC(=O)Nc1c(sc2c1c(COC)cc(n2)C)C(=O)c1ccccc1

STK688229
Synonyms: 7,9-dimethyl-2,4-diphenyl-4H-pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazine
Smiles: Cc1cc(C)c2c(n1)sc1c2N=C(OC1c1ccccc1)c1ccccc1

STK688230
Synonyms: 2,2'-[(1E,2E)-hydrazine-1,2-diylidenedi(1E)eth-1-yl-1-ylidene]bis[4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-amine]
Smiles: COCc1cc(C)nc2c1c(N)c(s2)/C(=N/N=C(/c1sc2c(c1N)c(COC)cc(n2)C)\C)/C

STK688231
Synonyms: 3-amino-2-butyl-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CCCCc1nc2c3c(C)cc(nc3sc2c(=O)n1N)C

STK688232
Synonyms: 5-chloro-3-cyano-4,6-dimethylpyridine-2-sulfonylchloride
Smiles: N#Cc1c(C)c(Cl)c(nc1S(=O)(=O)Cl)C

STK688234
Synonyms: 3-amino-4,5,6-trimethyl-N-(2-methyl-6-nitrophenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c(C)c(c(n2)C)C)Nc1c(C)cccc1[N+](=O)[O-]

STK688235
Synonyms: N-[4,6-dimethyl-2-(phenylcarbonyl)thieno[2,3-b]pyridin-3-yl]-4-nitrobenzamide
Smiles: Cc1cc(C)c2c(n1)sc(c2NC(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)c1ccccc1

STK688237
Synonyms: methyl6-({2-oxo-2-[(3,4,5-trimethoxyphenyl)amino]ethyl}sulfanyl)-3-[(trifluoroacetyl)amino]-1-benzothiophene-2-carboxylate
Smiles: COC(=O)c1sc2c(c1NC(=O)C(F)(F)F)ccc(c2)SCC(=O)Nc1cc(OC)c(c(c1)OC)OC

STK688241
Synonyms: methyl6-({2-[(3,5-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-3-[(trifluoroacetyl)amino]-1-benzothiophene-2-carboxylate
Smiles: COC(=O)c1sc2c(c1NC(=O)C(F)(F)F)ccc(c2)SCC(=O)Nc1cc(Cl)cc(c1)Cl

STK688245
Synonyms: 2-(6-fluoro-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)Cn1sc2c(c1=O)ccc(c2)F

STK688246
Synonyms: N-(3,4-dichlorophenyl)-2-(6-fluoro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetamide
Smiles: O=C(Cn1sc2c(c1=O)ccc(c2)F)Nc1ccc(c(c1)Cl)Cl

STK688247
Synonyms: N-(3,5-dichlorophenyl)-2-(6-fluoro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetamide
Smiles: O=C(Cn1sc2c(c1=O)ccc(c2)F)Nc1cc(Cl)cc(c1)Cl

STK688249
Synonyms: 2-(6-fluoro-3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(2,4,5-trichlorophenyl)acetamide
Smiles: O=C(Cn1sc2c(c1=O)ccc(c2)F)Nc1cc(Cl)c(cc1Cl)Cl

STK688250
Synonyms: 2-methyl-6-(2,2,2-trifluoroethoxy)-1-benzothiophen-3-amine1-oxide
Smiles: O=s1c2cc(OCC(F)(F)F)ccc2c(c1C)N

STK688252
Synonyms: 2-methyl-6-(2,2,2-trifluoroethoxy)-1-benzothiophen-3-amine1,1-dioxide
Smiles: NC1=C(C)S(=O)(=O)c2c1ccc(c2)OCC(F)(F)F

STK688253
Synonyms: 2-heptyl-6-(2,2,2-trifluoroethoxy)-1-benzothiophen-3-amine1,1-dioxide
Smiles: CCCCCCCC1=C(N)c2c(S1(=O)=O)cc(cc2)OCC(F)(F)F

STK688256
Synonyms: 8-chloro-6-methyl-2-(4-methylpiperidin-1-yl)pyrrolo[1,2-b:3,4-d']dipyridazin-5(6H)-one
Smiles: CC1CCN(CC1)c1ccc2n(n1)cc1c2c(=O)n(nc1Cl)C

STK688258
Synonyms: 5-amino-3-(thiophen-3-yl)-1,2-oxazole-4-carboxamide
Smiles: NC(=O)c1c(N)onc1c1cscc1

STK688262
Synonyms: N-(2-methylpropanoyl)-5-[(2-methylpropanoyl)amino]-3-(pyridin-2-yl)-1,2-oxazole-4-carboxamide
Smiles: CC(C(=O)NC(=O)c1c(onc1c1ccccn1)NC(=O)C(C)C)C

STK688268
Synonyms: 8-chloro-6-methyl-2-[(4-methylphenyl)sulfanyl]pyrrolo[1,2-b:3,4-d']dipyridazin-5(6H)-one
Smiles: Cc1ccc(cc1)Sc1ccc2n(n1)cc1c2c(=O)n(nc1Cl)C

STK688275
Synonyms: 5-(pyridin-2-yl)-3-(2,4,6-trichlorophenyl)-1,3,4-thiadiazol-2(3H)-imine
Smiles: Clc1cc(Cl)c(c(c1)Cl)n1nc(sc1=N)c1ccccn1

STK688280
Synonyms: 1-[2-methyl-5-phenyl-2-(thiophen-2-yl)-1,3,4-oxadiazol-3(2H)-yl]ethanone
Smiles: CC(=O)N1N=C(OC1(C)c1cccs1)c1ccccc1

STK688284
Synonyms: 3-[3-(hydroxymethyl)piperidin-1-yl]propanoicacid
Smiles: OCC1CCCN(C1)CCC(=O)O

STK688285
Synonyms: N-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,2,5-oxadiazol-3-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)Nc1nonc1N1C(=O)c2c(C1=O)cccc2

STK688288
Synonyms: 8-chloro-N-(4-methoxyphenyl)-N-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]quinazoline-7-sulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1cc2c(=O)nc3n(c2cc1Cl)ccs3)C

STK688291
Synonyms: 2-amino-5-oxo-4-phenyl-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccccc1)c(=O)nc1n2ccs1

STK688292
Synonyms: 2-amino-4-(3-nitrophenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cccc(c1)[N+](=O)[O-])c(=O)nc1n2ccs1

STK688294
Synonyms: 2-amino-4-(2-methoxyphenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccccc1OC)c(=O)nc1n2ccs1

STK688295
Synonyms: 2-amino-5-oxo-4-(3,4,5-trimethoxyphenyl)-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cc(OC)c(c(c1)OC)OC)c(=O)nc1n2ccs1

STK688297
Synonyms: 2-amino-4-(4-methoxyphenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)OC)c(=O)nc1n2ccs1

STK688298
Synonyms: 2-amino-4-(1,3-benzodioxol-5-yl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc3c(c1)OCO3)c(=O)nc1n2ccs1

STK688299
Synonyms: 2-amino-4-(4-bromophenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)Br)c(=O)nc1n2ccs1

STK688300
Synonyms: 2-amino-4-(2-fluorophenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccccc1F)c(=O)nc1n2ccs1

STK688301
Synonyms: 2-amino-5-oxo-4-[4-(prop-2-en-1-yloxy)phenyl]-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: C=CCOc1ccc(cc1)c1c(C#N)c(N)nc2c1c(=O)nc1n2ccs1

STK688302
Synonyms: 2-amino-4-[4-(benzyloxy)-3-methoxyphenyl]-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: COc1cc(ccc1OCc1ccccc1)c1c(C#N)c(N)nc2c1c(=O)nc1n2ccs1

STK688303
Synonyms: 2-amino-4-(5-bromo-2-fluorophenyl)-5-oxo-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1cc(Br)ccc1F)c(=O)nc1n2ccs1

STK688304
Synonyms: 4-(4-hydroxyphenyl)-3,4-dihydro-2H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-2,5(1H)-dione
Smiles: O=C1CC(c2ccc(cc2)O)c2c(N1)n1ccsc1nc2=O

STK688305
Synonyms: 2-amino-4-(1,3-benzodioxol-5-yl)-5,10-dioxo-5,10-dihydro-4H-benzo[g]chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1ccc3c(c1)OCO3)C(=O)c1c(C2=O)cccc1

STK688306
Synonyms: 3,4-bis(4-methoxyphenyl)-4,5-dihydropyrano[2,3-c]pyrazol-6(1H)-one
Smiles: COc1ccc(cc1)C1CC(=O)Oc2c1c(n[nH]2)c1ccc(cc1)OC

STK688307
Synonyms: 2-amino-1-(5-chloro-2-methylphenyl)-4-(5-nitrothiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1ccc(s1)[N+](=O)[O-])C(=O)CCC2)c1cc(Cl)ccc1C

STK688308
Synonyms: 7-phenyl[1,2,4]triazolo[4,3-b][1,2,4]triazin-3(2H)-one
Smiles: O=c1[nH]nc2n1ncc(n2)c1ccccc1

STK688311
Synonyms: (2E)-6-methyl-2-[2-(trifluoromethyl)benzylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Smiles: O=c1nc2s/c(=C/c3ccccc3C(F)(F)F)/c(=O)n2nc1C

STK688314
Synonyms: 1-[4-amino-2-(prop-2-en-1-ylamino)-1,3-thiazol-5-yl]ethanone
Smiles: C=CCNc1nc(c(s1)C(=O)C)N

STK688320
Synonyms: N-benzyl-2,4-dinitro-N-(2-{[4-(trifluoromethyl)phenyl]carbamoyl}phenyl)benzamide
Smiles: O=C(c1ccccc1N(C(=O)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])Cc1ccccc1)Nc1ccc(cc1)C(F)(F)F

STK688321
Synonyms: 3-(4-methoxybenzyl)-5-[(4-methylpyridin-2-yl)amino]-2-phenyl-5-(trifluoromethyl)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1)CN1C(=NC(C1=O)(Nc1nccc(c1)C)C(F)(F)F)c1ccccc1

STK688322
Synonyms: 3-(furan-2-yl)-7-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-5-one
Smiles: O=c1cc(sc2n1c(nn2)c1ccco1)c1ccccc1

STK688323
Synonyms: 1'-benzyl-3-[(4-methylphenyl)sulfonyl]-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)Cc1ccccc1

STK688324
Synonyms: 3-[(4-methylphenyl)sulfonyl]-8-nitro-1'-phenyl-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CCN2C(C1)C1(Cc3c2ccc(c3)[N+](=O)[O-])C(=O)NC(=O)N(C1=O)c1ccccc1

STK688325
Synonyms: 3'-(4-fluorophenyl)-1-[(3-phenylpyrrolidin-1-yl)methyl]-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)CSC21C(=O)N(c1c2cccc1)CN1CCC(C1)c1ccccc1

STK688326
Synonyms: 1-(4-fluorobenzyl)-3-[2-(furan-2-yl)-2-oxoethyl]-3-hydroxy-1,3-dihydro-2H-indol-2-one
Smiles: Fc1ccc(cc1)CN1c2ccccc2C(C1=O)(O)CC(=O)c1ccco1

STK688327
Synonyms: ethyl(2-{[(1-methyl-1H-indol-2-yl)carbonyl]amino}-1,3-thiazol-4-yl)acetate
Smiles: CCOC(=O)Cc1csc(n1)NC(=O)c1cc2c(n1C)cccc2

STK688328
Synonyms: 2-butyl-9-(methoxymethyl)-7-methyl-4H-pyrido[3',2':4,5]thieno[3,2-d][1,3]oxazin-4-imine
Smiles: CCCCc1oc(=N)c2c(n1)c1c(COC)cc(nc1s2)C

STK688330
Synonyms: N-(4-nitro-1H-benzimidazol-7-yl)acetamide
Smiles: CC(=O)Nc1ccc(c2c1[nH]cn2)[N+](=O)[O-]

STK688334
Synonyms: 1'-(4-methoxyphenyl)-3-nitro-6a,7,8,9,10,11-hexahydro-2'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-]

STK688335
Synonyms: ethyl4-(1,3-benzodioxol-5-yl)-6-({[(4-chlorophenyl)acetyl][2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1ccc2c(c1)OCO2)CN(C(=O)Cc1ccc(cc1)Cl)CCc1ccc(c(c1)OC)OC

STK688337
Synonyms: 4-(3-chlorophenyl)-6-{4-[(7-chloroquinolin-4-yl)amino]phenyl}-2-oxo-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(=O)[nH]c(cc1c1cccc(c1)Cl)c1ccc(cc1)Nc1ccnc2c1ccc(c2)Cl

STK688338
Synonyms: 4-(3-chlorophenyl)-2-oxo-6-(4-{[7-(trifluoromethyl)quinolin-4-yl]amino}phenyl)-1,2-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(=O)[nH]c(cc1c1cccc(c1)Cl)c1ccc(cc1)Nc1ccnc2c1ccc(c2)C(F)(F)F

STK688339
Synonyms: 4-(4-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}-1H-pyrazol-1-yl)butanoicacid
Smiles: OC(=O)CCCn1ncc(c1)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]

STK688340
Synonyms: (2E)-3-(3-nitrophenyl)-N-[4-(1H-pyrrol-1-yl)benzyl]prop-2-enamide
Smiles: O=C(/C=C/c1cccc(c1)[N+](=O)[O-])NCc1ccc(cc1)n1cccc1

STK688341
Synonyms: (2E)-3-(4-fluorophenyl)-N-[4-(1H-pyrrol-1-yl)benzyl]prop-2-enamide
Smiles: O=C(/C=C/c1ccc(cc1)F)NCc1ccc(cc1)n1cccc1

STK688344
Synonyms: methyl6-(dibromomethyl)-4-ethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCC1NC(=O)NC(=C1C(=O)OC)C(Br)Br

STK688345
Synonyms: 2-amino-5-oxo-4-(2,4,5-trimethoxyphenyl)-5H-pyrido[3,2-e][1,3]thiazolo[3,2-a]pyrimidine-3-carbonitrile
Smiles: COc1cc(OC)c(cc1c1c(C#N)c(N)nc2c1c(=O)nc1n2ccs1)OC

STK688347
Synonyms: 2-amino-4-(4-bromothiophen-2-yl)-5,10-dioxo-5,10-dihydro-4H-benzo[g]chromene-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C1c1scc(c1)Br)C(=O)c1c(C2=O)cccc1

STK688349
Synonyms: 2-amino-1-(3-fluorophenyl)-4-(5-nitrothiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2cccc(c2)F)C2=C(C1c1ccc(s1)[N+](=O)[O-])C(=O)CCC2

STK688351
Synonyms: 7-methyl-5-(piperidin-1-yl)[1,2,4]triazolo[4,3-a]pyrimidine
Smiles: Cc1cc(N2CCCCC2)n2c(n1)nnc2

STK688355
Synonyms: ethyl(2E)-2-(2-hydroxy-5-nitrobenzylidene)-3-oxo-7-phenyl-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(N=c2n(C1c1cccs1)c(=O)/c(=C\c1cc(ccc1O)[N+](=O)[O-])/s2)c1ccccc1

STK688356
Synonyms: 1-(3-chlorophenyl)-3,4-dimethyl-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Smiles: Clc1cccc(c1)n1nc(c2c1[nH]c(=O)cc2C)C

STK688358
Synonyms: (E)-1-phenyl-2-{4-[(triphenyl-lambda~5~-phosphanylidene)amino]phenyl}diazene
Smiles: c1ccc(cc1)/N=N/c1ccc(cc1)N=P(c1ccccc1)(c1ccccc1)c1ccccc1

STK688359
Synonyms: 3-[(4-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]propanoicacid
Smiles: OC(=O)CCSc1nc(C)cc(=O)[nH]1

STK688361
Synonyms: 4-acetyl-1-(2-bromoethyl)-5-(2,5-dimethoxyphenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: BrCCN1C(=O)C(=C(C1c1cc(OC)ccc1OC)C(=O)C)O

STK688362
Synonyms: 5-(3,4-dimethoxyphenyl)-1-[2-(dipropan-2-ylamino)ethyl]-3-hydroxy-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(ccc1OC)C1N(CCN(C(C)C)C(C)C)C(=O)C(=C1C(=O)c1ccccc1)O

STK688363
Synonyms: 4-acetyl-1-[2-(dipropan-2-ylamino)ethyl]-3-hydroxy-5-(3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cccc(c1)C1N(CCN(C(C)C)C(C)C)C(=O)C(=C1C(=O)C)O

STK688364
Synonyms: 5-hexyl-3-(4-methoxyphenyl)-4-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: CCCCCCN1C(c2ccccc2)c2c(C1=O)[nH]nc2c1ccc(cc1)OC

STK688365
Synonyms: 3-(4-chlorophenyl)-5-octyl-4-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: CCCCCCCCN1C(c2ccccc2)c2c(C1=O)[nH]nc2c1ccc(cc1)Cl

STK688366
Synonyms: 3-(4-methoxyphenyl)-5-octyl-4-phenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: CCCCCCCCN1C(c2ccccc2)c2c(C1=O)[nH]nc2c1ccc(cc1)OC

STK688367
Synonyms: 3-[4-(dimethylamino)phenyl]-3-[(4-methylphenyl)sulfanyl]-1-phenylpropan-1-one
Smiles: Cc1ccc(cc1)SC(c1ccc(cc1)N(C)C)CC(=O)c1ccccc1

STK688368
Synonyms: 1-benzyl-4-hydroxy-3-phenylquinolin-2(1H)-one
Smiles: Oc1c(c2ccccc2)c(=O)n(c2c1cccc2)Cc1ccccc1

STK688369
Synonyms: 2-[(4-chloro-3-methylphenyl)amino]benzoicacid
Smiles: OC(=O)c1ccccc1Nc1ccc(c(c1)C)Cl

STK688370
Synonyms: N-{3,5-dimethyl-4-[2-(morpholin-4-yl)-2-oxoethoxy]phenyl}thiophene-2-sulfonamide
Smiles: O=C(N1CCOCC1)COc1c(C)cc(cc1C)NS(=O)(=O)c1cccs1

STK688371
Synonyms: 3'-(4-methoxyphenyl)-1-({4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: COc1ccc(cc1)N1C(=O)CSC21c1ccccc1N(C2=O)CN1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK688372
Synonyms: 3'-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: O=C1CSC2(N1c1c(C)n(n(c1=O)c1ccccc1)C)c1ccccc1N(C2=O)CN1CCC2(CC1)OCCO2

STK688374
Synonyms: 2-(4-aminophenyl)-4-[4-(diethylamino)benzyl]-5-(morpholin-4-yl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCN(c1ccc(cc1)CC1C(=NN(C1=O)c1ccc(cc1)N)N1CCOCC1)CC

STK688375
Synonyms: N-{7-[(3-iodophenyl)carbonyl]-2,3-dihydro-1,4-benzodioxin-6-yl}-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1cc2OCCOc2cc1C(=O)c1cccc(c1)I

STK688376
Synonyms: 4-[({[5-(1,3-benzodioxol-5-yl)-4-(3,5-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoicacid
Smiles: O=C(Nc1ccc(cc1)C(=O)O)CSc1nnc(n1c1cc(Cl)cc(c1)Cl)c1ccc2c(c1)OCO2

STK688377
Synonyms: methyl4-[({[5-(3-tert-butyl-1H-pyrazol-5-yl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1[nH]nc(c1)C(C)(C)C

STK688378
Synonyms: 2-(4-methoxyphenyl)-N'-({[4-methyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)acetohydrazide
Smiles: COc1ccc(cc1)CC(=O)NNC(=O)CSc1nnc(n1C)c1nccnc1

STK688379
Synonyms: N'-(2-{[4-methyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)thiophene-2-carbohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cnccn1)NNC(=O)c1cccs1

STK688380
Synonyms: ethyl4-methyl-5-[(2-methylphenyl)carbamoyl]-2-({[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}amino)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)N2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)sc(c1C)C(=O)Nc1ccccc1C

STK688381
Synonyms: ethyl6-ethyl-2-({[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)N2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)sc2c1CCC(C2)CC

STK688382
Synonyms: methyl2-({[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}amino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)N2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)sc2c1CCCCCCCCCC2

STK688383
Synonyms: ethyl6-methyl-2-({[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)N2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)sc2c1CCC(C2)C

STK688384
Synonyms: methyl2-({[(5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)N2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)sc2c1CCCC2

STK688385
Synonyms: 1,3-dimethyl-8-(morpholin-4-ylsulfonyl)-6H-pyrimido[1,2-a]quinazolin-6-one
Smiles: Cc1cc(C)n2c(n1)nc(=O)c1c2ccc(c1)S(=O)(=O)N1CCOCC1

STK688390
Synonyms: 2,6-di-tert-butyl-4-[(2,6-dichlorophenyl)imino]cyclohexa-2,5-dien-1-one
Smiles: CC(C1=C/C(=N/c2c(Cl)cccc2Cl)/C=C(C1=O)C(C)(C)C)(C)C

STK688392
Synonyms: 1,1'-[oxybis(ethane-2,1-diylimino)]dianthracene-9,10-dione
Smiles: O=C1c2c(NCCOCCNc3cccc4c3C(=O)c3ccccc3C4=O)cccc2C(=O)c2c1cccc2

STK688393
Synonyms: 2-[acetyl(3-chloro-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino]ethylbenzoate
Smiles: CC(=O)N(C1=C(Cl)C(=O)c2c(C1=O)cccc2)CCOC(=O)c1ccccc1

STK688394
Synonyms: 2-{acetyl[3-(morpholin-4-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]amino}ethylbenzoate
Smiles: CC(=O)N(C1=C(N2CCOCC2)C(=O)c2c(C1=O)cccc2)CCOC(=O)c1ccccc1

STK688397
Synonyms: 1,3-dibromo-5-fluoro-2-nitrosobenzene
Smiles: O=Nc1c(Br)cc(cc1Br)F

STK688398
Synonyms: 1,3-dibromo-5-fluoro-2-nitrobenzene
Smiles: Brc1cc(F)cc(c1[N+](=O)[O-])Br

STK688399
Synonyms: 1,2,3-trimethyl-5-(trifluoromethyl)-1,8-dihydro-7H-pyrrolo[3,2-g]quinolin-7-one
Smiles: O=c1[nH]c2cc3n(C)c(c(c3cc2c(c1)C(F)(F)F)C)C

STK688400
Synonyms: ethyl(2E)-3-[(1,2,3-trimethyl-1H-indol-6-yl)amino]but-2-enoate
Smiles: CCOC(=O)/C=C(/Nc1ccc2c(c1)n(C)c(c2C)C)\C

STK688405
Synonyms: 1,2,3,6,8,9-hexamethyl-1H-pyrrolo[2,3-g]quinoline
Smiles: Cc1cc(C)c2c(n1)cc1c(c2C)n(c(c1C)C)C

STK688406
Synonyms: N-(2,3-dimethyl-1H-indol-6-yl)-4,4,4-trifluoro-3-oxobutanamide
Smiles: O=C(CC(=O)C(F)(F)F)Nc1ccc2c(c1)[nH]c(c2C)C

STK688408
Synonyms: N-phenyl-2H-3,4'-bi-1,2,4-triazole-5-carboxamide
Smiles: O=C(c1n[nH]c(n1)n1cnnc1)Nc1ccccc1

STK688414
Synonyms: N-[4-(trifluoromethyl)phenyl]-2H-3,4'-bi-1,2,4-triazole-5-carboxamide
Smiles: O=C(c1n[nH]c(n1)n1cnnc1)Nc1ccc(cc1)C(F)(F)F

STK688419
Synonyms: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2H-3,4'-bi-1,2,4-triazole-5-carboxamide
Smiles: N#Cc1c(NC(=O)c2n[nH]c(n2)n2cnnc2)sc2c1CCCC2

STK688420
Synonyms: 4-(4-cyclohexylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Smiles: C1CCC(CC1)N1CCN(CC1)c1nc2ccccc2n2c1nnc2

STK688423
Synonyms: ethyl6-({[(4-chlorophenyl)acetyl](pyridin-3-ylmethyl)amino}methyl)-4-(3-fluorophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)NC1c1cccc(c1)F)CN(C(=O)Cc1ccc(cc1)Cl)Cc1cccnc1

STK688425
Synonyms: 3-(4-methoxyphenyl)-4-phenyl-5-propyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Smiles: CCCN1C(c2ccccc2)c2c(C1=O)[nH]nc2c1ccc(cc1)OC

STK688427
Synonyms: ethyl1-{[3-(ethoxycarbonyl)-5-methoxy-1-benzofuran-2-yl]methyl}-4-phenylpiperidine-4-carboxylate
Smiles: CCOC(=O)c1c(CN2CCC(CC2)(C(=O)OCC)c2ccccc2)oc2c1cc(OC)cc2

STK688428
Synonyms: ethyl1-benzyl-2-{[4-(ethoxycarbonyl)-4-phenylpiperidin-1-yl]methyl}-5-hydroxy-1H-indole-3-carboxylate
Smiles: CCOC(=O)c1c2cc(O)ccc2n(c1CN1CCC(CC1)(C(=O)OCC)c1ccccc1)Cc1ccccc1

STK688429
Synonyms: ethyl1-[(6-bromo-5-methoxy-2-methyl-1-phenyl-1H-indol-3-yl)carbonyl]-4-phenylpiperidine-4-carboxylate
Smiles: CCOC(=O)C1(CCN(CC1)C(=O)c1c2cc(OC)c(cc2n(c1C)c1ccccc1)Br)c1ccccc1

STK688435
Synonyms: ethyl1-({5-methoxy-2-[(4-methoxyphenoxy)methyl]-1-benzofuran-3-yl}carbonyl)-4-phenylpiperidine-4-carboxylate
Smiles: CCOC(=O)C1(CCN(CC1)C(=O)c1c(COc2ccc(cc2)OC)oc2c1cc(OC)cc2)c1ccccc1

STK688440
Synonyms: 1,2-bis(4-iodo-1H-pyrazol-1-yl)ethanone
Smiles: Ic1cnn(c1)CC(=O)n1ncc(c1)I

STK688446
Synonyms: 1-[2-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-hydroxy-4-methyl-1H-imidazol-5-yl]ethanone
Smiles: COc1cc(cc(c1O)Cl)c1nc(c(n1O)C(=O)C)C

STK688447
Synonyms: 3-(1,3-benzothiazol-2-yl)-1'-(4-methoxyphenyl)-8-nitro-2,3,4,4a-tetrahydro-1H,2'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: COc1ccc(cc1)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)c1nc2c(s1)cccc2)[N+](=O)[O-]

STK688448
Synonyms: 3-hydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-ylhexopyranoside
Smiles: OCC1OC(OC2=C(O)C(=O)c3c(C2=O)cccc3)C(C(C1O)O)O

STK688450
Synonyms: N,N'-bis(3,4-dichlorophenyl)-1,2,5-oxadiazole-3,4-dicarboxamide2-oxide
Smiles: O=C(c1no[n+](c1C(=O)Nc1ccc(c(c1)Cl)Cl)[O-])Nc1ccc(c(c1)Cl)Cl

STK688451
Synonyms: N,N'-bis(4-chlorophenyl)-1,2,5-oxadiazole-3,4-dicarboxamide2-oxide
Smiles: Clc1ccc(cc1)NC(=O)c1[n+]([O-])onc1C(=O)Nc1ccc(cc1)Cl

STK688462
Synonyms: 3-(5-chloro-2-hydroxyphenyl)-5-nitro-1,3-dihydro-2H-indol-2-one
Smiles: O=C1Nc2c(C1c1cc(Cl)ccc1O)cc(cc2)[N+](=O)[O-]