COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
FULL DB
Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )
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STK773453
Synonyms: N-(3-nitropyridin-4-yl)benzene-1,2-diamine
Smiles: Nc1ccccc1Nc1ccncc1[N+](=O)[O-]
STK773454
Synonyms: 2-(4-benzyl-2,2-dimethyltetrahydro-2H-pyran-4-yl)-N-(4-fluorobenzyl)ethanamine
Smiles: Fc1ccc(cc1)CNCCC1(CCOC(C1)(C)C)Cc1ccccc1
STK773455
Synonyms: N-(1H-benzimidazol-7-yl)-4-(trifluoromethoxy)benzenesulfonamide
Smiles: FC(Oc1ccc(cc1)S(=O)(=O)Nc1cccc2c1[nH]cn2)(F)F
STK773456
Synonyms: N-(1H-indazol-7-yl)-4-(trifluoromethoxy)benzenesulfonamide
Smiles: FC(Oc1ccc(cc1)S(=O)(=O)Nc1cccc2c1[nH]nc2)(F)F
STK773459
Synonyms: 1-(2-cyanoethyl)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1-methylthiourea
Smiles: N#CCCN(C(=S)Nc1c(C)n(n(c1=O)c1ccccc1)C)C
STK773460
Synonyms: 1-(cyclopropylmethyl)-3-(2-fluorophenyl)-1-propylthiourea
Smiles: CCCN(C(=S)Nc1ccccc1F)CC1CC1
STK773461
Synonyms: 1-(3-cyanophenyl)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiourea
Smiles: N#Cc1cccc(c1)NC(=S)Nc1c(C)n(n(c1=O)c1ccccc1)C
STK773462
Synonyms: N-benzyl-4-(2-fluorophenyl)piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)c1ccccc1F)NCc1ccccc1
STK773463
Synonyms: 1,1'-propane-1,2-diylbis[3-(2,6-dimethylphenyl)(thiourea)]
Smiles: CC(NC(=S)Nc1c(C)cccc1C)CNC(=S)Nc1c(C)cccc1C
STK773464
Synonyms: 3-(3,4-dimethylphenyl)-1-methyl-1-[2-(pyridin-2-yl)ethyl]thiourea
Smiles: S=C(N(CCc1ccccn1)C)Nc1ccc(c(c1)C)C
STK773466
Synonyms: ethyl4-[(4-methoxy-6-methylpyrimidin-2-yl)oxy]benzoate
Smiles: CCOC(=O)c1ccc(cc1)Oc1nc(C)cc(n1)OC
STK773468
Synonyms: N-(2-methoxy-5-nitrophenyl)-7,7-dimethyl-2-oxo-1,8-dioxaspiro[4.5]decane-4-carboxamide
Smiles: COc1ccc(cc1NC(=O)C1CC(=O)OC21CCOC(C2)(C)C)[N+](=O)[O-]
STK773469
Synonyms: 3,4-diamino-N,N'-bis(4-chlorophenyl)thieno[2,3-b]thiophene-2,5-dicarboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1sc2c(c1N)c(c(s2)C(=O)Nc1ccc(cc1)Cl)N
STK773470
Synonyms: ethyl2-{[4-(ethoxycarbonyl)piperazin-1-yl]methyl}-5-hydroxy-1-phenyl-1H-indole-3-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cc1n(c2ccccc2)c2c(c1C(=O)OCC)cc(cc2)O
STK773472
Synonyms: 2-[(3-methoxyphenyl)amino]-N-phenylpyridine-3-carboxamide
Smiles: COc1cccc(c1)Nc1ncccc1C(=O)Nc1ccccc1
STK773473
Synonyms: 2-[(4-nitrophenyl)amino]-N-phenylpyridine-3-carboxamide
Smiles: O=C(c1cccnc1Nc1ccc(cc1)[N+](=O)[O-])Nc1ccccc1
STK773476
Synonyms: 1-(3-chlorophenyl)-7,7-dimethyl-4-(thiophen-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Clc1cccc(c1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cscc1
STK773479
Synonyms: 2-amino-1-(dimethylamino)-4-[4-(dimethylamino)phenyl]-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc(cc1)N(C)C)C(=O)CC(C2)(C)C
STK773480
Synonyms: 2-amino-1-(dimethylamino)-4-[5-ethyl-2-(ethylsulfanyl)thiophen-3-yl]-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: CCSc1sc(cc1C1C(=C(N)N(C2=C1C(=O)CC(C2)(C)C)N(C)C)C#N)CC
STK773481
Synonyms: N-[(E)-1,3-benzodioxol-5-ylmethylidene]piperidin-1-amine
Smiles: C1CCN(CC1)/N=C/c1ccc2c(c1)OCO2
STK773484
Synonyms: N-(2-methoxyphenyl)-3,4-dihydroquinoline-1(2H)-carbothioamide
Smiles: COc1ccccc1NC(=S)N1CCCc2c1cccc2
STK773485
Synonyms: N-[(E)-(3-fluorophenyl)methylidene]piperidin-1-amine
Smiles: Fc1cccc(c1)/C=N/N1CCCCC1
STK773486
Synonyms: N-(3-methoxyphenyl)-3,4-dihydroquinoline-1(2H)-carbothioamide
Smiles: COc1cccc(c1)NC(=S)N1CCCc2c1cccc2
STK773487
Synonyms: N-benzyl-2-methylpiperidine-1-carbothioamide
Smiles: CC1CCCCN1C(=S)NCc1ccccc1
STK773488
Synonyms: N-(2-ethoxyphenyl)-3,4-dihydroquinoline-1(2H)-carbothioamide
Smiles: CCOc1ccccc1NC(=S)N1CCCc2c1cccc2
STK773489
Synonyms: 3-(2,6-dimethylphenyl)-1-ethyl-1-(pyridin-4-ylmethyl)thiourea
Smiles: CCN(C(=S)Nc1c(C)cccc1C)Cc1ccncc1
STK773490
Synonyms: 1-(2-benzylphenyl)-3-[2-(morpholin-4-yl)ethyl]thiourea
Smiles: S=C(Nc1ccccc1Cc1ccccc1)NCCN1CCOCC1
STK773491
Synonyms: 2-(7-chloroquinolin-4-yl)-N-[4-(propan-2-yl)phenyl]hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1)C(C)C)NNc1ccnc2c1ccc(c2)Cl
STK773492
Synonyms: 3-(4-acetylphenyl)-1-(cyclopropylmethyl)-1-propylthiourea
Smiles: CCCN(C(=S)Nc1ccc(cc1)C(=O)C)CC1CC1
STK773493
Synonyms: 1-(2,6-dimethylphenyl)-3-[2-(pyridin-2-yl)ethyl]thiourea
Smiles: S=C(Nc1c(C)cccc1C)NCCc1ccccn1
STK773495
Synonyms: ethyl5-(4-methylphenyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccc(cc1)C)c1nonc1n1cccc1
STK773496
Synonyms: 3-nitrodibenzo[b,f]oxepine
Smiles: [O-][N+](=O)c1ccc2c(c1)Oc1ccccc1C=C2
STK773497
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(3-nitrophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1cccc(c1)[N+](=O)[O-]
STK773498
Synonyms: ethyl3-(2-chlorophenyl)-3-[(thiophen-2-ylcarbonyl)amino]propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1cccs1
STK773499
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(2,6-dichlorophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1c(Cl)cccc1Cl
STK773500
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(2-fluorophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1ccccc1F
STK773501
Synonyms: ethyl3-(2-chlorophenyl)-3-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)C12CC3CC(C2)CC(C1)C3
STK773503
Synonyms: ethyl3-(4-ethoxyphenyl)-3-{[(2-methyl-6-nitrophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OCC)NC(=O)c1c(C)cccc1[N+](=O)[O-]
STK773504
Synonyms: 2-amino-4-(2,5-dimethoxyphenyl)-1-(dimethylamino)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(c(c1)C1C(=C(N)N(C2=C1C(=O)CC(C2)(C)C)N(C)C)C#N)OC
STK773505
Synonyms: ethyl2-[(3-oxocyclohex-1-en-1-yl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC2=CC(=O)CCC2)sc2c1CCCCC2
STK773507
Synonyms: ethyl3-{[(4-chloro-3-nitrophenyl)carbonyl]amino}-3-(2-chlorophenyl)propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
STK773508
Synonyms: ethyl3-({[4-(acetylamino)phenyl]sulfonyl}amino)-3-(2-chlorophenyl)propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NS(=O)(=O)c1ccc(cc1)NC(=O)C
STK773509
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(2-nitrophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1ccccc1[N+](=O)[O-]
STK773510
Synonyms: 5-benzyl-2-[4-(trifluoromethoxy)phenyl]-2,5-dihydro-3H-pyridazino[4,3-b]indol-3-one
Smiles: O=c1cc2c(nn1c1ccc(cc1)OC(F)(F)F)c1c(n2Cc2ccccc2)cccc1
STK773511
Synonyms: N,N'-bis[2-(morpholin-4-yl)ethyl]hydrazine-1,2-dicarbothioamide
Smiles: S=C(NNC(=S)NCCN1CCOCC1)NCCN1CCOCC1
STK773512
Synonyms: 1-benzyl-3-[2-(morpholin-4-yl)ethyl]-1-propan-2-ylthiourea
Smiles: CC(N(C(=S)NCCN1CCOCC1)Cc1ccccc1)C
STK773513
Synonyms: 1-ethyl-3-(2-phenylethyl)-1-(pyridin-4-ylmethyl)thiourea
Smiles: CCN(C(=S)NCCc1ccccc1)Cc1ccncc1
STK773515
Synonyms: 1,1'-pentane-1,3-diylbis[3-phenyl(thiourea)]
Smiles: CCC(NC(=S)Nc1ccccc1)CCNC(=S)Nc1ccccc1
STK773516
Synonyms: (2E)-N-(pyridin-3-yl)-2-(3,4,5-trimethoxybenzylidene)hydrazinecarbothioamide
Smiles: COc1cc(/C=N/NC(=S)Nc2cccnc2)cc(c1OC)OC
STK773518
Synonyms: N-(4-acetylphenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide
Smiles: OCC1CCCN(C1)C(=S)Nc1ccc(cc1)C(=O)C
STK773519
Synonyms: 1,1'-(2,2-dimethylpropane-1,3-diyl)bis[3-(3-methoxyphenyl)(thiourea)]
Smiles: COc1cccc(c1)NC(=S)NCC(CNC(=S)Nc1cccc(c1)OC)(C)C
STK773520
Synonyms: 4-(azepan-1-yl)-6-(1H-imidazol-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine
Smiles: C1CCCN(CC1)c1nc(nc(n1)n1cncc1)N(c1ccccc1)c1ccccc1
STK773521
Synonyms: N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl}benzamide
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(C1=O)(NC(=O)c1ccccc1)C(F)(F)F
STK773522
Synonyms: ethyl3-{[(2,6-dichlorophenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1c(Cl)cccc1Cl
STK773524
Synonyms: N-[1-(2-fluorophenyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)NC1(NC(=O)N(C1=O)c1ccccc1F)C(F)(F)F
STK773528
Synonyms: methyl3-({4-(3,4-dihydroisoquinolin-2(1H)-yl)-6-[(2-fluorophenyl)amino]-1,3,5-triazin-2-yl}oxy)benzoate
Smiles: COC(=O)c1cccc(c1)Oc1nc(nc(n1)N1CCc2c(C1)cccc2)Nc1ccccc1F
STK773535
Synonyms: 2-amino-1-(dimethylamino)-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CCC2
STK773536
Synonyms: 2-amino-1-(dimethylamino)-7,7-dimethyl-5-oxo-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)(C)C
STK773537
Synonyms: 2-amino-4-(2,5-dimethoxyphenyl)-1-(dimethylamino)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(c(c1)C1C(=C(N)N(C2=C1C(=O)CCC2)N(C)C)C#N)OC
STK773539
Synonyms: 3-bromobenzyl5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
Smiles: Brc1cccc(c1)COC(=O)c1nn(nc1N)c1ccccc1
STK773541
Synonyms: N-[4-(cyanomethyl)phenyl]-2-(5-phenyl-2H-tetrazol-2-yl)acetamide
Smiles: N#CCc1ccc(cc1)NC(=O)Cn1nnc(n1)c1ccccc1
STK773542
Synonyms: 2,4-dichlorobenzyl1,2-dimethyl-4-nitro-1H-imidazole-5-carboxylate
Smiles: Clc1ccc(c(c1)Cl)COC(=O)c1c(nc(n1C)C)[N+](=O)[O-]
STK773543
Synonyms: 6-({[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}methyl)-N,N-dimethyl-1,3,5-triazine-2,4-diamine
Smiles: Nc1nc(CSc2nnnn2c2ccc3c(c2)OCO3)nc(n1)N(C)C
STK773544
Synonyms: N,N-dimethyl-6-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-1,3,5-triazine-2,4-diamine
Smiles: Nc1nc(nc(n1)N(C)C)Cn1c(C)ncc1[N+](=O)[O-]
STK773545
Synonyms: 6-{[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]methyl}-N,N-dimethyl-1,3,5-triazine-2,4-diamine
Smiles: Nc1nc(nc(n1)N(C)C)Cn1c(nc2c1cccc2)c1nonc1N
STK773546
Synonyms: ethyl3-{[(2,5-dichlorophenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1cc(Cl)ccc1Cl
STK773547
Synonyms: ethyl3-(4-methylphenyl)-3-[(9H-xanthen-9-ylcarbonyl)amino]propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)C1c2ccccc2Oc2c1cccc2
STK773548
Synonyms: ethyl3-[(benzylsulfonyl)amino]-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NS(=O)(=O)Cc1ccccc1
STK773549
Synonyms: 7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-8-[(pyridin-2-ylmethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1cccc(c1Cn1c(SCc2ccccn2)nc2c1c(=O)n(c(=O)n2C)C)Cl
STK773550
Synonyms: 8-(4-butanoylphenoxy)-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCC(=O)c1ccc(cc1)Oc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C
STK773552
Synonyms: methyl4-[({[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)CSc1nnc2c(n1)n(C(C)C)c1c2cccc1
STK773553
Synonyms: N-(2-methoxyphenyl)-2-({1-[4-(trifluoromethoxy)phenyl]-1H-tetrazol-5-yl}sulfanyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnnn1c1ccc(cc1)OC(F)(F)F
STK773554
Synonyms: 2-{[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnnn1c1ccc(cc1C)C
STK773555
Synonyms: N-[4-(butan-2-yl)phenyl]-2-({1-[4-(trifluoromethoxy)phenyl]-1H-tetrazol-5-yl}sulfanyl)acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnnn1c1ccc(cc1)OC(F)(F)F)C
STK773556
Synonyms: N-(2-cyano-4,5-diethoxyphenyl)-2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Smiles: CCOc1cc(NC(=O)CSc2nc3c(n2C)c(=O)n(c(=O)n3C)C)c(cc1OCC)C#N
STK773557
Synonyms: N-(2,4-difluorophenyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnnn1C
STK773558
Synonyms: 2-{[7-(4-tert-butylbenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
Smiles: O=C(Nc1ccccc1F)CSc1nc2c(n1Cc1ccc(cc1)C(C)(C)C)c(=O)n(c(=O)n2C)C
STK773559
Synonyms: 3-{[4-(2-fluorophenyl)piperazin-1-yl]carbonyl}-8-methoxy-6-nitro-2H-chromen-2-one
Smiles: COc1cc(cc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)c1ccccc1F)[N+](=O)[O-]
STK773561
Synonyms: N-(2,5-dimethoxyphenyl)-8-methoxy-6-nitro-2-oxo-2H-chromene-3-carboxamide
Smiles: COc1ccc(c(c1)NC(=O)c1cc2cc(cc(c2oc1=O)OC)[N+](=O)[O-])OC
STK773562
Synonyms: 2-chloro-N-(2-cyano-4,5-diethoxyphenyl)pyridine-3-carboxamide
Smiles: CCOc1cc(NC(=O)c2cccnc2Cl)c(cc1OCC)C#N
STK773563
Synonyms: N-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-8-methoxy-2-oxo-2H-chromene-3-carboxamide
Smiles: COc1cccc2c1oc(=O)c(c2)C(=O)NCCc1c(C)[nH]c2c1cc(F)cc2
STK773564
Synonyms: (4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)(4-methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)n1nc(c(c1C)Br)C
STK773565
Synonyms: [2-methyl-4-(naphthalen-1-yl)-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl](phenyl)methanone
Smiles: CC1=C(C(=O)c2ccccc2)C(n2c(N1)nc1c2cccc1)c1cccc2c1cccc2
STK773566
Synonyms: 1,1'-methanediylbis(2-methyl-5-nitro-1H-imidazole)
Smiles: [O-][N+](=O)c1cnc(n1Cn1c(C)ncc1[N+](=O)[O-])C
STK773567
Synonyms: 7-nitro-3-(phenylcarbonyl)-1,3,4-benzothiadiazepin-2(3H)-one
Smiles: O=C1Sc2ccc(cc2C=NN1C(=O)c1ccccc1)[N+](=O)[O-]
STK773568
Synonyms: 2,4-dichlorobenzyl3-[2-(2,4-dichlorobenzyl)-2H-tetrazol-5-yl]benzoate
Smiles: Clc1ccc(c(c1)Cl)COC(=O)c1cccc(c1)c1nnn(n1)Cc1ccc(cc1Cl)Cl
STK773570
Synonyms: 3-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(N1CCc1c(C)[nH]c3c1cc(F)cc3)(C)O)CCCCC2
STK773572
Synonyms: 3-[2-(7-fluoro-2-methyl-1H-indol-3-yl)ethyl]-4-hydroxy-4,5,5-trimethyl-1,3-oxazolidin-2-one
Smiles: O=C1OC(C(N1CCc1c(C)[nH]c2c1cccc2F)(C)O)(C)C
STK773573
Synonyms: 5-bromo-2-methoxy-N-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)ethyl]benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCCOC12CC3CC(C2)CC(C1)C3)Br
STK773574
Synonyms: 3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl}-8-methoxy-6-nitro-2H-chromen-2-one
Smiles: COc1cc(cc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)c1cccc(c1C)C)[N+](=O)[O-]
STK773576
Synonyms: N-(2-{5-[chloro(difluoro)methoxy]-2-methyl-1H-indol-3-yl}ethyl)-4-methoxy-2,5-dimethylbenzenesulfonamide
Smiles: COc1cc(C)c(cc1C)S(=O)(=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(Cl)(F)F
STK773577
Synonyms: N-(2-{5-[chloro(difluoro)methoxy]-2-methyl-1H-indol-3-yl}ethyl)-2-methoxy-5-methylbenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(Cl)(F)F)C
STK773578
Synonyms: 2-chloro-N-(2-{5-[chloro(difluoro)methoxy]-2-methyl-1H-indol-3-yl}ethyl)-5-nitrobenzenesulfonamide
Smiles: Clc1ccc(cc1S(=O)(=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(Cl)(F)F)[N+](=O)[O-]
STK773579
Synonyms: N-(2-{5-[chloro(difluoro)methoxy]-2-methyl-1H-indol-3-yl}ethyl)-2-methyl-5-(propan-2-yl)benzenesulfonamide
Smiles: Cc1ccc(cc1S(=O)(=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(Cl)(F)F)C(C)C
STK773581
Synonyms: (2E)-3-(3,4-dimethoxyphenyl)-1-(1-hydroxycyclohexyl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)C2(O)CCCCC2)ccc1OC
STK773582
Synonyms: N-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-4-methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)NCCc1c(C)[nH]c2c1cccc2Cl
STK773583
Synonyms: N-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-2,4,6-trimethylbenzenesulfonamide
Smiles: Cc1cc(C)c(c(c1)C)S(=O)(=O)NCCc1c(C)[nH]c2c1cccc2Cl
STK773584
Synonyms: N-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-2-methyl-5-nitrobenzenesulfonamide
Smiles: Cc1[nH]c2c(c1CCNS(=O)(=O)c1cc(ccc1C)[N+](=O)[O-])cccc2Cl
STK773586
Synonyms: 2-(morpholin-4-yl)-6-(3-nitrophenyl)-4,4-bis(trifluoromethyl)-4H-1,3,5-oxadiazine
Smiles: [O-][N+](=O)c1cccc(c1)C1=NC(N=C(O1)N1CCOCC1)(C(F)(F)F)C(F)(F)F
STK773589
Synonyms: ethyl3-{[(2-methyl-6-nitrophenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1c(C)cccc1[N+](=O)[O-]
STK773590
Synonyms: 3,3'-(1,3,4-oxadiazole-2,5-diyl)bis[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazole]
Smiles: c1ccn(c1)c1nonc1c1nnc(o1)c1nonc1n1cccc1
STK773591
Synonyms: tetrahydrofuran-2-ylmethyl6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1ccc(cc1C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OCC1CCCO1)OC
STK773592
Synonyms: cycloheptyl6-(4-fluorophenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: Fc1ccc(cc1)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OC1CCCCCC1
STK773594
Synonyms: 2-methylpropyl6-(4-fluorophenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: CC(COC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccc(cc1)F)C
STK773596
Synonyms: cyclopentyl6-(4-fluorophenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: Fc1ccc(cc1)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OC1CCCC1
STK773597
Synonyms: butan-2-yl6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: CCC(OC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1cc(OC)ccc1OC)C
STK773598
Synonyms: 6-chloro-3-[2-(4-chlorophenyl)ethyl]-5,7-dimethyl-3,4-dihydro-2H-1,3-benzoxazine
Smiles: Clc1ccc(cc1)CCN1COc2c(C1)c(C)c(c(c2)C)Cl
STK773600
Synonyms: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-fluorophenyl)-3-(2-methylphenoxy)azetidin-2-one
Smiles: COc1ccc(cc1OC)CCN1C(=O)C(C1c1cccc(c1)F)Oc1ccccc1C
STK773601
Synonyms: cycloheptyl6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1ccc(cc1C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OC1CCCCCC1)OC
STK773604
Synonyms: propan-2-yl6-(4-fluorophenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: CC(OC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccc(cc1)F)C
STK773606
Synonyms: 2-methoxyethyl6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COCCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1cc(OC)ccc1OC
STK773607
Synonyms: cyclohexylmethyl6-(4-fluorophenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: Fc1ccc(cc1)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OCC1CCCCC1
STK773608
Synonyms: 6-bromo-3-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H-1,3-benzoxazine
Smiles: Clc1ccc(cc1)CCN1COc2c(C1)cc(cc2)Br
STK773609
Synonyms: methyl6-(4-fluorophenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1ccc(cc1)F
STK773612
Synonyms: 4-(2-chlorophenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methylphenoxy)azetidin-2-one
Smiles: COc1ccc(cc1OC)CCN1C(=O)C(C1c1ccccc1Cl)Oc1ccccc1C
STK773613
Synonyms: 2-methylpropyl6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1ccc(cc1C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OCC(C)C)OC
STK773616
Synonyms: 6-chloro-3-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-2H-1,3-benzoxazine
Smiles: Clc1ccc(cc1)CCN1COc2c(C1)cc(cc2)Cl
STK773617
Synonyms: 4-chloro-N,N-diphenyl-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-amine
Smiles: Clc1nc(nc(n1)N(c1ccccc1)c1ccccc1)N1CCCC1
STK773618
Synonyms: [4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]cyanamide
Smiles: N#CNc1nc(nc(n1)N1CCOCC1)N1CCOCC1
STK773619
Synonyms: 4-(diphenylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazine-2-carbonitrile
Smiles: N#Cc1nc(nc(n1)N(c1ccccc1)c1ccccc1)N1CCCC1
STK773620
Synonyms: 5-amino-1-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-1H-1,2,3-triazole-4-carbonitrile
Smiles: N#Cc1nnn(c1N)c1nc(nc(n1)N1CCOCC1)N1CCOCC1
STK773621
Synonyms: N~2~-cyano-N~2~-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]glycinamide
Smiles: N#CN(c1nc(nc(n1)N1CCOCC1)N1CCOCC1)CC(=O)N
STK773623
Synonyms: dipentyl2,2'-{[6-(cyanomethoxy)-1,3,5-triazine-2,4-diyl]diimino}diacetate(non-preferredname)
Smiles: CCCCCOC(=O)CNc1nc(NCC(=O)OCCCCC)nc(n1)OCC#N
STK773624
Synonyms: ethyl1-[4-(diphenylamino)-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1C)c1nc(nc(n1)N(c1ccccc1)c1ccccc1)N1CCCC1
STK773627
Synonyms: N-(3-methoxyphenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
Smiles: COc1cccc(c1)NS(=O)(=O)c1nn2c(n1)nc(cc2C)C
STK773628
Synonyms: N-cyclohexyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)S(=O)(=O)NC1CCCCC1
STK773629
Synonyms: 4-chloro-N-{3-[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)oxy]phenyl}benzamide
Smiles: N#Cc1c(Oc2cccc(c2)NC(=O)c2ccc(cc2)Cl)nc(c(c1C)Cl)C
STK773634
Synonyms: N-(benzylcarbamoyl)-2,5,6-trichloro-4-methylpyridine-3-carboxamide
Smiles: O=C(NC(=O)c1c(Cl)nc(c(c1C)Cl)Cl)NCc1ccccc1
STK773635
Synonyms: N-benzyl-N-ethyl-8-methoxyquinoline-5-sulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(c2c1cccn2)OC)Cc1ccccc1
STK773637
Synonyms: 3-amino-5-chloro-4,6-dimethyl-N-(quinolin-8-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c(C)c(c(n2)C)Cl)Nc1cccc2c1nccc2
STK773638
Synonyms: 2-{[(4,4-diphenyl-4H-3,1-benzoxazin-2-yl)methyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile
Smiles: N#Cc1c(C)cc(nc1SCC1=Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1)C
STK773639
Synonyms: 2-(4,4-diphenyl-4H-3,1-benzoxazin-2-yl)-4-(methoxymethyl)-6-methylthieno[2,3-b]pyridin-3-amine
Smiles: COCc1cc(C)nc2c1c(N)c(s2)C1=Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1
STK773640
Synonyms: 5-chloro-2-(4,4-diphenyl-4H-3,1-benzoxazin-2-yl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine
Smiles: Cc1nc2sc(c(c2c(c1Cl)C)N)C1=Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1
STK773641
Synonyms: 2-(4,4-diphenyl-4H-3,1-benzoxazin-2-yl)-4,6-dimethylthieno[2,3-b]pyridin-3-amine
Smiles: Cc1cc(C)c2c(n1)sc(c2N)C1=Nc2ccccc2C(O1)(c1ccccc1)c1ccccc1
STK773642
Synonyms: 2-[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetamide
Smiles: N#Cc1c(SCC(=O)N)nc(c(c1C)Cl)C
STK773644
Synonyms: 3-amino-N,N-dibenzyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
Smiles: Cc1cc(C)c2c(n1)sc(c2N)C(=O)N(Cc1ccccc1)Cc1ccccc1
STK773645
Synonyms: N,N-dibenzyl-2-[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetamide
Smiles: N#Cc1c(SCC(=O)N(Cc2ccccc2)Cc2ccccc2)nc(c(c1C)Cl)C
STK773646
Synonyms: 2-(7,9-dimethyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl)-4,5-diethoxybenzonitrile
Smiles: CCOc1cc(c(cc1OCC)C#N)n1nnc2c(c1=O)sc1c2c(C)cc(n1)C
STK773647
Synonyms: N,N-dibenzyl-2-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetamide
Smiles: N#Cc1c(C)cc(nc1SCC(=O)N(Cc1ccccc1)Cc1ccccc1)C
STK773648
Synonyms: 3-amino-N,N-dibenzyl-5-chloro-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c(C)c(c(n2)C)Cl)N(Cc1ccccc1)Cc1ccccc1
STK773649
Synonyms: 4-{(E)-[(2-methoxy-4-nitrophenyl)imino]methyl}-3-methyl-1-(4-methylphenyl)-1H-pyrazol-5-ol
Smiles: COc1cc(ccc1/N=C/c1c(C)nn(c1O)c1ccc(cc1)C)[N+](=O)[O-]
STK773650
Synonyms: 1',3'-dimethyl-3-nitro-1',6',6a,7,8,9,10,11-octahydro-2'H,5H-spiro[azepino[1,2-a]quinoline-6,5'-pyrimidine]-2',4'(3'H)-dione
Smiles: CN1CC2(Cc3cc(ccc3N3C2CCCCC3)[N+](=O)[O-])C(=O)N(C1=O)C
STK773651
Synonyms: (4Z)-2-(2,4-dibromophenyl)-4-{[(3-methoxypropyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COCCCN/C=C\1/C(=NN(C1=O)c1ccc(cc1Br)Br)C
STK773653
Synonyms: 6-amino-4-(6-nitro-1,3-benzodioxol-5-yl)-3-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc3OCOc3cc1[N+](=O)[O-])c(n[nH]2)c1ccccc1
STK773654
Synonyms: 5-{5-nitro-2-[4-(phenylcarbonyl)piperazin-1-yl]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(=Cc2cc(ccc2N2CCN(CC2)C(=O)c2ccccc2)[N+](=O)[O-])C(=O)N1
STK773655
Synonyms: 1-(4-methoxybenzyl)-5-phenyl-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Smiles: COc1ccc(cc1)CN1N=NC2C1C(=O)N(C2=O)c1ccccc1
STK773658
Synonyms: 1-(diphenylmethyl)-3-[2-(morpholin-4-yl)ethyl]thiourea
Smiles: S=C(NC(c1ccccc1)c1ccccc1)NCCN1CCOCC1
STK773659
Synonyms: N-benzyl-2-ethylpiperidine-1-carbothioamide
Smiles: CCC1CCCCN1C(=S)NCc1ccccc1
STK773660
Synonyms: 5-(4-chlorophenyl)-3-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: Clc1ccc(cc1)c1[nH]c(=O)c2c(n1)n(C)c(=S)s2
STK773661
Synonyms: 7-(2,3-dihydro-1H-indol-1-yl)-5-methyl-3-phenyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: Cc1nc(N2CCc3c2cccc3)c2c(n1)n(c1ccccc1)c(=S)s2
STK773662
Synonyms: 3-benzyl-5-[4-(prop-2-en-1-yloxy)phenyl]-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: C=CCOc1ccc(cc1)c1[nH]c(=O)c2c(n1)n(Cc1ccccc1)c(=S)s2
STK773663
Synonyms: 3-ethyl-5-(thiophen-2-yl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: CCn1c(=S)sc2c1nc([nH]c2=O)c1cccs1
STK773664
Synonyms: 5'-butyl-1-(2-chlorobenzyl)-3'-ethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)C2C(C1=O)C1(NC2CC)c2ccccc2N(C1=O)Cc1ccccc1Cl
STK773666
Synonyms: 7-(diethylamino)-5-methyl-3-phenyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCN(c1nc(C)nc2c1sc(=S)n2c1ccccc1)CC
STK773667
Synonyms: 5-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-3-(prop-2-en-1-yl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: C=CCOc1ccc(cc1OC)c1[nH]c(=O)c2c(n1)n(CC=C)c(=S)s2
STK773668
Synonyms: N-(furan-2-ylmethyl)-2,5-dimethylthiophene-3-sulfonamide
Smiles: Cc1sc(c(c1)S(=O)(=O)NCc1ccco1)C
STK773670
Synonyms: N-(2-butoxyphenyl)-2,5-dimethylthiophene-3-sulfonamide
Smiles: CCCCOc1ccccc1NS(=O)(=O)c1cc(sc1C)C
STK773672
Synonyms: 2,5-dimethyl-N-(3-nitrophenyl)thiophene-3-sulfonamide
Smiles: Cc1sc(c(c1)S(=O)(=O)Nc1cccc(c1)[N+](=O)[O-])C
STK773673
Synonyms: 3-ethyl-5-(3-hydroxy-4-methoxyphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: COc1ccc(cc1O)c1[nH]c(=O)c2c(n1)n(CC)c(=S)s2
STK773674
Synonyms: (2E)-1-(1-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-en-1-one
Smiles: Oc1ccc(cc1)/C=C/C(=O)C1(O)CCCCC1
STK773675
Synonyms: ethyl5-(4-nitrophenyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1n1cccc1
STK773677
Synonyms: 2-nitro-N-[2-(2-oxoimidazolidin-1-yl)ethyl]benzenesulfonamide
Smiles: O=C1NCCN1CCNS(=O)(=O)c1ccccc1[N+](=O)[O-]
STK773680
Synonyms: 2-{benzyl[2-nitro-4-(trifluoromethyl)phenyl]amino}ethylbenzoate
Smiles: [O-][N+](=O)c1cc(ccc1N(Cc1ccccc1)CCOC(=O)c1ccccc1)C(F)(F)F
STK773682
Synonyms: 2-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-10H-pyridazino[6,1-b]quinazolin-10-one
Smiles: Fc1ccc(cc1)/C=N/Nc1ccc2n(n1)c(=O)c1c(n2)cccc1
STK773683
Synonyms: 2-(5-chloro-2-methoxyphenyl)-6-phenyl-3-propyl-2,5,6,7-tetrahydro-4H-indazol-4-one
Smiles: CCCc1c2C(=O)CC(Cc2nn1c1cc(Cl)ccc1OC)c1ccccc1
STK773684
Synonyms: 2-(2-fluorophenyl)-6-phenyl-3-propyl-2,5,6,7-tetrahydro-4H-indazol-4-one
Smiles: CCCc1c2C(=O)CC(Cc2nn1c1ccccc1F)c1ccccc1
STK773686
Synonyms: 2-{2-(3,4-diethoxyphenyl)-1-[(2-hydroxyphenyl)amino]ethylidene}-5,5-dimethylcyclohexane-1,3-dione
Smiles: CCOc1cc(ccc1OCC)CC(=C1C(=O)CC(CC1=O)(C)C)Nc1ccccc1O
STK773687
Synonyms: 4-(2,5-dimethoxyphenyl)-N-(2,4-dimethylphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
Smiles: COc1ccc(cc1C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)Nc1ccc(cc1C)C)OC
STK773688
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{[3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSc1nc2ccccc2c(=O)n1c1cccc(c1)C
STK773689
Synonyms: N-(2,4-dimethylphenyl)-2-methyl-4-[4-(pentyloxy)phenyl]-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
Smiles: CCCCCOc1ccc(cc1)C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)Nc1ccc(cc1C)C
STK773690
Synonyms: [4-(2,4-dimethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl](phenyl)methanone
Smiles: COc1cc(OC)ccc1C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)c1ccccc1
STK773691
Synonyms: 4-(2,4-dimethoxyphenyl)-N-(2,4-dimethylphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
Smiles: COc1cc(OC)ccc1C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)Nc1ccc(cc1C)C
STK773692
Synonyms: [4-(2,5-dimethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl](phenyl)methanone
Smiles: COc1ccc(c(c1)C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)c1ccccc1)OC
STK773693
Synonyms: 4-(4,5-dimethoxy-2-nitrophenyl)-2-methyl-N-phenyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
Smiles: COc1cc(c(cc1OC)[N+](=O)[O-])C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)Nc1ccccc1
STK773694
Synonyms: N-(2,4-dimethylphenyl)-2-methyl-4-{4-[methyl(phenyl)amino]phenyl}-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
Smiles: Cc1ccc(c(c1)C)NC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)N(c1ccccc1)C)c1ccccc1n2
STK773695
Synonyms: [4-(3,4-dimethoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl](phenyl)methanone
Smiles: COc1cc(ccc1OC)C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)c1ccccc1
STK773696
Synonyms: 4-(4-tert-butylphenyl)-N-(2,4-dimethylphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide
Smiles: Cc1ccc(c(c1)C)NC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)C(C)(C)C)c1ccccc1n2
STK773697
Synonyms: [4-(2-methoxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl](phenyl)methanone
Smiles: COc1ccccc1C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)c1ccccc1
STK773698
Synonyms: (2-methyl-4-{4-[methyl(phenyl)amino]phenyl}-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl)(phenyl)methanone
Smiles: CN(c1ccccc1)c1ccc(cc1)C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)c1ccccc1
STK773699
Synonyms: [4-(4,5-dimethoxy-2-nitrophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl](phenyl)methanone
Smiles: COc1cc(c(cc1OC)[N+](=O)[O-])C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)c1ccccc1
STK773700
Synonyms: [4-(4-iodophenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3-yl](phenyl)methanone
Smiles: Ic1ccc(cc1)C1C(=C(C)Nc2n1c1ccccc1n2)C(=O)c1ccccc1
STK773701
Synonyms: 4-nitro-N-[2-(4-phenylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Nc1cc(ccc1N1CCN(CC1)c1ccccc1)C(F)(F)F
STK773702
Synonyms: 2-nitro-N-[2-(4-phenylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide
Smiles: [O-][N+](=O)c1ccccc1C(=O)Nc1cc(ccc1N1CCN(CC1)c1ccccc1)C(F)(F)F
STK773703
Synonyms: 3-nitro-N-[2-(4-phenylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Nc1cc(ccc1N1CCN(CC1)c1ccccc1)C(F)(F)F
STK773705
Synonyms: 4-methoxy-3-nitro-N-[2-(4-phenylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]benzamide
Smiles: COc1ccc(cc1[N+](=O)[O-])C(=O)Nc1cc(ccc1N1CCN(CC1)c1ccccc1)C(F)(F)F
STK773706
Synonyms: 2,2-diphenyl-N-[2-(4-phenylpiperazin-1-yl)-5-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(C(c1ccccc1)c1ccccc1)Nc1cc(ccc1N1CCN(CC1)c1ccccc1)C(F)(F)F
STK773708
Synonyms: 3-{[4-nitro-2-(trifluoromethyl)phenyl]amino}propyl(3-chlorophenyl)carbamate
Smiles: O=C(Nc1cccc(c1)Cl)OCCCNc1ccc(cc1C(F)(F)F)[N+](=O)[O-]
STK773710
Synonyms: 6-[(2-methylpiperidin-1-yl)sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Smiles: O=C1COc2c(N1)cc(cc2)S(=O)(=O)N1CCCCC1C
STK773712
Synonyms: 2-[4-(trifluoromethoxy)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: FC(Oc1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1)(F)F
STK773713
Synonyms: 3-methyl-4-(4-methylbenzyl)-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,5-dione
Smiles: Cc1ccc(cc1)CC1C(C)C(=O)N(C1=O)c1ccc(cc1)OC(F)(F)F
STK773716
Synonyms: 8-(4-fluorophenyl)-7-(4-methoxyphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1)c1cn2c(n1c1ccc(cc1)F)nc1c2c(=O)n(C)c(=O)n1C
STK773722
Synonyms: 5,7-dimethyl-N-(2-phenylethyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)S(=O)(=O)NCCc1ccccc1
STK773723
Synonyms: 5,7-dimethyl-N,N-dipropyl[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
Smiles: CCCN(S(=O)(=O)c1nn2c(n1)nc(cc2C)C)CCC
STK773724
Synonyms: 2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nn2c(n1)nc(cc2C)C
STK773725
Synonyms: 3-amino-5-chloro-N-(4-fluorophenyl)-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1sc2c(c1N)c(C)c(c(n2)C)Cl
STK773726
Synonyms: 3-{[(2-chlorophenyl)carbonyl]amino}-N-(4-fluorophenyl)-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1sc2c(c1NC(=O)c1ccccc1Cl)c(C)cc(n2)C
STK773727
Synonyms: N-(4-fluorophenyl)-4,6-dimethyl-3-{[(4-methylphenyl)carbonyl]amino}thieno[2,3-b]pyridine-2-carboxamide
Smiles: Cc1ccc(cc1)C(=O)Nc1c(sc2c1c(C)cc(n2)C)C(=O)Nc1ccc(cc1)F
STK773730
Synonyms: 2-[(6-methyl-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl)sulfanyl]-N-(2-phenylethyl)acetamide
Smiles: O=C(CSc1nc(C)cc2c1C(=O)OC2)NCCc1ccccc1
STK773733
Synonyms: N-ethyl-8-methoxyquinoline-5-sulfonamide
Smiles: CCNS(=O)(=O)c1ccc(c2c1cccn2)OC
STK773736
Synonyms: 2,5-dichloro-N-(4-chlorobenzyl)-4,6-dimethylpyridine-3-carboxamide
Smiles: Clc1ccc(cc1)CNC(=O)c1c(Cl)nc(c(c1C)Cl)C
STK773737
Synonyms: 2,5,6-trichloro-4-methyl-N-[(3-methylbutyl)carbamoyl]pyridine-3-carboxamide
Smiles: CC(CCNC(=O)NC(=O)c1c(Cl)nc(c(c1C)Cl)Cl)C
STK773738
Synonyms: 2,5-dichloro-N,4,6-trimethyl-N-phenylpyridine-3-carboxamide
Smiles: O=C(c1c(Cl)nc(c(c1C)Cl)C)N(c1ccccc1)C
STK773739
Synonyms: 7,9-dimethyl-3-(3-methylphenyl)pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Smiles: Cc1cccc(c1)n1nnc2c(c1=O)sc1c2c(C)cc(n1)C
STK773740
Synonyms: 3-(4-methoxyphenyl)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Smiles: COc1ccc(cc1)n1nnc2c(c1=O)sc1c2c(C)cc(n1)C
STK773741
Synonyms: N-(4-fluorophenyl)-2-({4-methyl-5-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1C)Cn1cnc(n1)[N+](=O)[O-]
STK773743
Synonyms: 2-{[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-(5-methyl-1,2-oxazol-3-yl)butanamide
Smiles: CCC(C(=O)Nc1noc(c1)C)Sc1nc(=O)cc(n1CCc1ccccc1)N
STK773744
Synonyms: 2-{[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-(2-cyanophenyl)butanamide
Smiles: CCC(C(=O)Nc1ccccc1C#N)Sc1nc(=O)cc(n1CCc1ccccc1)N
STK773745
Synonyms: ethyl3-{[(4-chlorophenoxy)acetyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)COc1ccc(cc1)Cl
STK773746
Synonyms: ethyl3-(4-methylphenyl)-3-[(2-phenylbutanoyl)amino]propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)C(c1ccccc1)CC
STK773747
Synonyms: ethyl3-{[(4-chloro-3-nitrophenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
STL264237
Synonyms: 2-({1-[4-(acetylamino)phenyl]-4-phenyl-1H-imidazol-2-yl}sulfanyl)-N-phenyl-N-(propan-2-yl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)n1cc(nc1SCC(=O)N(c1ccccc1)C(C)C)c1ccccc1
STL191474
Synonyms: ethyl[(5-methyl-1,2-oxazol-3-yl)carbamothioyl]carbamate
Smiles: CCOC(=O)NC(=S)Nc1noc(c1)C
STL299796
Synonyms: 4-methoxy-2-(morpholin-4-yl)-1,3-thiazole-5-carbaldehyde
Smiles: COc1nc(sc1C=O)N1CCOCC1
STL299797
Synonyms: 2,4-dichloro-1,3-thiazole-5-carbaldehyde
Smiles: O=Cc1sc(nc1Cl)Cl
STL299803
Synonyms: but-3-en-2-one
Smiles: CC(=O)C=C
STL264238
Synonyms: acetylchloride
Smiles: CC(=O)Cl
STL264239
Synonyms: 3-methylbutylnitrite
Smiles: CC(CCON=O)C
STL299804
Synonyms: 1-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)methanamine
Smiles: NCc1nnc2n1CCCCC2
STL299805
Synonyms: 6-(2-amino-1,3-thiazol-4-yl)-5-methyl-3-phenylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Smiles: Nc1scc(n1)c1sc2c(c1C)c(=O)n(c(=O)[nH]2)c1ccccc1
STL299806
Synonyms: ethyl(2Z)-4-chloro-2-[2-(4-methylphenyl)hydrazinylidene]-3-oxobutanoate
Smiles: CCOC(=O)/C(=N\Nc1ccc(cc1)C)/C(=O)CCl
STL200434
Synonyms: methyl3-amino-4-(phenylsulfonyl)thiophene-2-carboxylate
Smiles: COC(=O)c1scc(c1N)S(=O)(=O)c1ccccc1
STL299808
Synonyms: calciumbis{3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate}
Smiles: OCC(C(C(=O)NCCC(=O)O[Ca]OC(=O)CCNC(=O)C(C(CO)(C)C)O)O)(C)C
STL299809
Synonyms: 5-methoxy-3,4-dihydro-2H-pyrrole
Smiles: COC1=NCCC1
STL299810
Synonyms: 6-methoxy-2,3,4,5-tetrahydropyridine
Smiles: COC1=NCCCC1
STL299811
Synonyms: 7-methoxy-3,4,5,6-tetrahydro-2H-azepine
Smiles: COC1=NCCCCC1
STL264240
Synonyms: aceticacid
Smiles: CC(=O)O
STL264241
Synonyms: ethane-1,2-diamine
Smiles: NCCN
STL264242
Synonyms: N,N-dimethylmethanamine
Smiles: CN(C)C
STL264243
Synonyms: formicacid
Smiles: OC=O
STL264246
Synonyms: chloroacetaldehyde
Smiles: ClCC=O
STL264247
Synonyms: 2-methylpropane-2-thiol
Smiles: CC(S)(C)C
STL264248
Synonyms: bariumdiacetate
Smiles: CC(=O)O[Ba]OC(=O)C
STL264249
Synonyms: acetaldehyde
Smiles: CC=O
STL264250
Synonyms: 2,3-dihydroxybutanedioate
Smiles: OC(C(C(=O)[O-])O)C(=O)[O-]
STL264251
Synonyms: 2,4-diaminophenol
Smiles: Nc1ccc(c(c1)N)O
STL264252
Synonyms: N,N-dimethyl-4-nitrosoaniline
Smiles: O=Nc1ccc(cc1)N(C)C
STK701193
Synonyms: methyl4-(2-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: COC(=O)C1=C(C)NC(=O)NC1c1ccccc1OC
STK093279
Synonyms: 4-{[(E)-(4-fluorophenyl)methylidene]amino}benzoicacid
Smiles: Fc1ccc(cc1)/C=N/c1ccc(cc1)C(=O)O
STL200447
Synonyms: N-[4-(diethylamino)benzyl]pyridin-2-amine
Smiles: CCN(c1ccc(cc1)CNc1ccccn1)CC
STL200450
Synonyms: N-(3,4-dimethoxybenzyl)pyridin-2-amine
Smiles: COc1cc(CNc2ccccn2)ccc1OC
STL300015
Synonyms: 1-(pyridin-3-yl)butane-1,3-dione
Smiles: CC(=O)CC(=O)c1cccnc1
STL264253
Synonyms: 2-(2-oxo-2-phenylethyl)isoquinoliniumbromide
Smiles: O=C(c1ccccc1)C[n+]1ccc2c(c1)cccc2.[Br-]
STL264254
Synonyms: 2-[2-(4-bromophenyl)-2-oxoethyl]isoquinoliniumbromide
Smiles: Brc1ccc(cc1)C(=O)C[n+]1ccc2c(c1)cccc2.[Br-]
STK701389
Synonyms: 2-{(E)-2-[5-(4-bromophenyl)furan-2-yl]ethenyl}-1,3-benzoxazole
Smiles: Brc1ccc(cc1)c1ccc(o1)/C=C/c1nc2c(o1)cccc2
STL200469
Synonyms: N-[1-(2-carbamoylphenoxy)-2,2,2-trichloroethyl]-3-chlorobenzamide
Smiles: Clc1cccc(c1)C(=O)NC(C(Cl)(Cl)Cl)Oc1ccccc1C(=O)N
STL200470
Synonyms: diprop-2-en-1-yl4-(4-hydroxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: C=CCOC(=O)C1=C(C)NC(=C(C1c1ccc(cc1)O)C(=O)OCC=C)C
STL200471
Synonyms: 4-methyl-N-[2,2,2-tribromo-1-(naphthalen-2-ylamino)ethyl]benzamide
Smiles: Cc1ccc(cc1)C(=O)NC(C(Br)(Br)Br)Nc1ccc2c(c1)cccc2
STL200472
Synonyms: 4-methyl-N-[2,2,2-tribromo-1-(naphthalen-2-yloxy)ethyl]benzamide
Smiles: Cc1ccc(cc1)C(=O)NC(C(Br)(Br)Br)Oc1ccc2c(c1)cccc2
STL200473
Synonyms: 4-methyl-N-{2,2,2-tribromo-1-[(4-chlorophenyl)amino]ethyl}benzamide
Smiles: Cc1ccc(cc1)C(=O)NC(C(Br)(Br)Br)Nc1ccc(cc1)Cl
STL200474
Synonyms: N-[2,2,2-tribromo-1-(2-bromophenoxy)ethyl]benzamide
Smiles: O=C(c1ccccc1)NC(C(Br)(Br)Br)Oc1ccccc1Br
STK903342
Synonyms: N-[1-(benzylamino)-2,2,2-tribromoethyl]benzamide
Smiles: O=C(c1ccccc1)NC(C(Br)(Br)Br)NCc1ccccc1
STL200475
Synonyms: N-{2,2,2-tribromo-1-[(4-sulfamoylphenyl)amino]ethyl}benzamide
Smiles: O=C(c1ccccc1)NC(C(Br)(Br)Br)Nc1ccc(cc1)S(=O)(=O)N
STK903343
Synonyms: N-{2,2,2-trichloro-1-[({2-[(2-hydroxyphenyl)carbonyl]hydrazinyl}carbonothioyl)amino]ethyl}butanamide
Smiles: CCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NNC(=O)c1ccccc1O
STK773748
Synonyms: ethyl3-{[(4-chloro-2-nitrophenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccc(cc1[N+](=O)[O-])Cl
STK773749
Synonyms: ethyl3-(4-methylphenyl)-3-{[(4-methylphenyl)sulfonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NS(=O)(=O)c1ccc(cc1)C
STK773750
Synonyms: ethyl3-{[(4-ethoxyphenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccc(cc1)OCC
STK773751
Synonyms: ethyl3-(4-methylphenyl)-3-{[(2-nitrophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccccc1[N+](=O)[O-]
STK773752
Synonyms: 2-{[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CSc1nnnn1c1ccc(cc1C)C
STK773753
Synonyms: 5-[({[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetyl)amino]-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Smiles: O=C(Nc1nn(nc1C(=O)N)c1ccccc1)CSc1nnnn1c1ccc(cc1C)C
STK773754
Synonyms: N-[2-(3,4-diethoxyphenyl)ethyl]-2-{[1-(2,4-dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
Smiles: CCOc1cc(CCNC(=O)CSc2nnnn2c2ccc(cc2C)C)ccc1OCC
STK773755
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(2-methyl-6-nitrophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1c(C)cccc1[N+](=O)[O-]
STK773761
Synonyms: 2-propoxyethyl6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: CCCOCCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1cc(OC)ccc1OC
STK773762
Synonyms: methyl6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1ccc(c(c1)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OC)OC
STK773764
Synonyms: 3-benzyl-5-(3,4-diethoxyphenyl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: CCOc1cc(ccc1OCC)c1[nH]c(=O)c2c(n1)n(Cc1ccccc1)c(=S)s2
STK773766
Synonyms: 3-[4-(4-methylphenyl)-1-oxophthalazin-2(1H)-yl]-N-[4-(trifluoromethoxy)phenyl]propanamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CCn1nc(c2ccc(cc2)C)c2c(c1=O)cccc2
STK773767
Synonyms: 3-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]-N-[4-(trifluoromethoxy)phenyl]propanamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CCn1nc(c2ccc(cc2)Cl)c2c(c1=O)cccc2
STK773768
Synonyms: 2-{4-[(2,5-dimethylthiophen-3-yl)sulfonyl]piperazin-1-yl}-1,3-benzoxazole
Smiles: Cc1sc(c(c1)S(=O)(=O)N1CCN(CC1)c1nc2c(o1)cccc2)C
STK773769
Synonyms: 2-{2-(3,4-diethoxyphenyl)-1-[(3-methoxyphenyl)amino]ethylidene}-5,5-dimethylcyclohexane-1,3-dione
Smiles: CCOc1cc(ccc1OCC)CC(=C1C(=O)CC(CC1=O)(C)C)Nc1cccc(c1)OC
STK773770
Synonyms: 1,1'-(2,2-dimethylpropane-1,3-diyl)bis[3-(2,5-dimethylphenyl)(thiourea)]
Smiles: S=C(Nc1cc(C)ccc1C)NCC(CNC(=S)Nc1cc(C)ccc1C)(C)C
STK773771
Synonyms: N-(2-cyano-4,5-diethoxyphenyl)-2-(3,4-dimethoxyphenyl)acetamide
Smiles: CCOc1cc(NC(=O)Cc2ccc(c(c2)OC)OC)c(cc1OCC)C#N
STK773774
Synonyms: N-(2-cyano-4,5-diethoxyphenyl)pyridine-4-carboxamide
Smiles: CCOc1cc(NC(=O)c2ccncc2)c(cc1OCC)C#N
STK773777
Synonyms: 4-chloro-N-(2-cyano-4,5-diethoxyphenyl)-3-nitrobenzamide
Smiles: CCOc1cc(NC(=O)c2ccc(c(c2)[N+](=O)[O-])Cl)c(cc1OCC)C#N
STK773779
Synonyms: 2-(1H-benzotriazol-1-yl)-N-(2-cyano-4,5-diethoxyphenyl)acetamide
Smiles: CCOc1cc(NC(=O)Cn2nnc3c2cccc3)c(cc1OCC)C#N
STK773780
Synonyms: N-(2-cyano-4,5-diethoxyphenyl)-2-(naphthalen-2-yloxy)acetamide
Smiles: CCOc1cc(NC(=O)COc2ccc3c(c2)cccc3)c(cc1OCC)C#N
STK773781
Synonyms: N-(2-cyano-4,5-diethoxyphenyl)-2-(2,3-dihydro-1H-inden-5-yloxy)acetamide
Smiles: CCOc1cc(NC(=O)COc2ccc3c(c2)CCC3)c(cc1OCC)C#N
STK773782
Synonyms: 2-(5-{4-[(2-fluorobenzyl)oxy]phenyl}-2H-tetrazol-2-yl)-N-[3-(hexyloxy)phenyl]acetamide
Smiles: CCCCCCOc1cccc(c1)NC(=O)Cn1nnc(n1)c1ccc(cc1)OCc1ccccc1F
STK773784
Synonyms: 4-(acetylamino)-N-(3-benzyl-5-{2-[(3-methylphenyl)amino]-2-oxoethyl}-4-oxo-2-thioxoimidazolidin-1-yl)butanamide
Smiles: O=C(NN1C(CC(=O)Nc2cccc(c2)C)C(=O)N(C1=S)Cc1ccccc1)CCCNC(=O)C
STK773786
Synonyms: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-cyclopropylthiourea
Smiles: S=C(Nc1cc(ccc1Cl)C(F)(F)F)NC1CC1
STK773787
Synonyms: N'',N'''-bis[(E)-(3,4,5-trimethoxyphenyl)methylidene]thiocarbonohydrazide
Smiles: COc1cc(/C=N/NC(=S)N/N=C/c2cc(OC)c(c(c2)OC)OC)cc(c1OC)OC
STK773788
Synonyms: N-phenyl-2-{[3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxamide
Smiles: O=C(c1cccnc1Nc1cccc(c1)C(F)(F)F)Nc1ccccc1
STK773790
Synonyms: N-(4-fluorophenyl)-2-[(2-phenylethyl)amino]pyridine-3-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1cccnc1NCCc1ccccc1
STK773791
Synonyms: N-(4-fluorophenyl)-2-(morpholin-4-yl)pyridine-3-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1cccnc1N1CCOCC1
STK773795
Synonyms: 1-(2,4-dichlorophenyl)-3-(5-hydroxynaphthalen-1-yl)thiourea
Smiles: S=C(Nc1cccc2c1cccc2O)Nc1ccc(cc1Cl)Cl
STK773796
Synonyms: N-[(E)-(4-butoxyphenyl)methylidene]morpholin-4-amine
Smiles: CCCCOc1ccc(cc1)/C=N/N1CCOCC1
STK773797
Synonyms: 1-(4-methoxyphenyl)-3-[2-(morpholin-4-yl)phenyl]thiourea
Smiles: COc1ccc(cc1)NC(=S)Nc1ccccc1N1CCOCC1
STK773798
Synonyms: 1-(2,6-dimethylphenyl)-3-[3-(2-oxopyrrolidin-1-yl)propyl]thiourea
Smiles: S=C(Nc1c(C)cccc1C)NCCCN1CCCC1=O
STK773799
Synonyms: ethyl3-(4-methylphenyl)-3-{[(4-methylphenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccc(cc1)C
STK773800
Synonyms: ethyl3-{[(2-fluorophenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccccc1F
STK773801
Synonyms: ethyl3-(4-methylphenyl)-3-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)C12CC3CC(C2)CC(C1)C3
STK773802
Synonyms: ethyl3-{[(3,4-dimethoxyphenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccc(c(c1)OC)OC
STK773803
Synonyms: ethyl3-{[(4-fluorophenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccc(cc1)F
STK773804
Synonyms: ethyl3-(4-methylphenyl)-3-{[(2-methylphenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccccc1C
STK773805
Synonyms: ethyl3-{[(2-chloro-4-nitrophenyl)carbonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1ccc(cc1Cl)[N+](=O)[O-]
STK773806
Synonyms: ethyl5-(3-nitrophenyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1c1cccc(c1)[N+](=O)[O-])c1nonc1n1cccc1
STK773807
Synonyms: ethyl1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[ethyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1CN(c1ccccc1)CC)c1nonc1N
STK773808
Synonyms: 5-benzyl-2-{4-[chloro(difluoro)methoxy]phenyl}-2,5-dihydro-3H-pyridazino[4,3-b]indol-3-one
Smiles: O=c1cc2c(nn1c1ccc(cc1)OC(Cl)(F)F)c1c(n2Cc2ccccc2)cccc1
STK773809
Synonyms: 1-(2-chlorophenyl)-3-(5,6-dimethyl-1H-benzimidazol-1-yl)pyrrolidine-2,5-dione
Smiles: O=C1CC(C(=O)N1c1ccccc1Cl)n1cnc2c1cc(C)c(c2)C
STK773810
Synonyms: ethyl3-(2-chlorophenyl)-3-[(phenylacetyl)amino]propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)Cc1ccccc1
STK773812
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(3,4-dimethoxyphenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1ccc(c(c1)OC)OC
STK773813
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(4-fluorophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1ccc(cc1)F
STK773814
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(2-methylphenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1ccccc1C
STK773815
Synonyms: ethyl3-{[(2-chloro-4-nitrophenyl)carbonyl]amino}-3-(2-chlorophenyl)propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1ccc(cc1Cl)[N+](=O)[O-]
STK773816
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(2,5-dichlorophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1cc(Cl)ccc1Cl
STK773818
Synonyms: ethyl3-{[(4-chloro-2-nitrophenyl)carbonyl]amino}-3-(2-chlorophenyl)propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1ccc(cc1[N+](=O)[O-])Cl
STK773819
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(4-fluorophenyl)acetyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)Cc1ccc(cc1)F
STK773822
Synonyms: N,N'-bis(4-acetylphenyl)-2-methylpiperazine-1,4-dicarbothioamide
Smiles: S=C(N1CCN(C(C1)C)C(=S)Nc1ccc(cc1)C(=O)C)Nc1ccc(cc1)C(=O)C
STK773823
Synonyms: 4-(2,3-dimethylphenyl)-N-(pyridin-3-yl)piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)c1cccc(c1C)C)Nc1cccnc1
STK773824
Synonyms: ethyl3-(4-methylphenyl)-3-{[(3-nitrophenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1cccc(c1)[N+](=O)[O-]
STK773825
Synonyms: ethyl3-(4-methylphenyl)-3-[(thiophen-2-ylcarbonyl)amino]propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1cccs1
STK773827
Synonyms: 3-(3,4-dimethoxyphenyl)-7,9-dimethyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Smiles: COc1cc(ccc1OC)C1=NNc2n(C1)c1c(=O)n(C)c(=O)n(c1n2)C
STK773828
Synonyms: 7-(3,4-dimethoxyphenyl)-8-(4-hydroxybutyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: OCCCCn1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(c(c1)OC)OC
STK773829
Synonyms: 7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(4-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(ccc1OC)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCC(CC1)C
STK773830
Synonyms: 2,4-di-tert-butyl-6-(pyridin-2-ylamino)phenol
Smiles: Oc1c(Nc2ccccn2)cc(cc1C(C)(C)C)C(C)(C)C
STK773831
Synonyms: 2,4-di-tert-butyl-6-[(4-methyl-2-nitrophenyl)amino]phenol
Smiles: Cc1ccc(c(c1)[N+](=O)[O-])Nc1cc(cc(c1O)C(C)(C)C)C(C)(C)C
STK773832
Synonyms: 3-chloro-N-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-1-benzothiophene-2-carboxamide
Smiles: Cc1ccc2c(c1)c(CCNC(=O)c1sc3c(c1Cl)cccc3)c([nH]2)C
STK773833
Synonyms: 7,9-dichloro-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(Cl)cc1Cl)[N+](=O)[O-]
STK773834
Synonyms: 7-methoxy-2-[(4-methylphenyl)sulfonyl]-4-nitro-2,11-dihydro[1]benzoxepino[4,3,2-cd]indole
Smiles: COc1cccc2c1Oc1cc(cc3c1c(C2)cn3S(=O)(=O)c1ccc(cc1)C)[N+](=O)[O-]
STK773835
Synonyms: 6-(3-ethoxy-4-hydroxyphenyl)-1-phenyl-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Smiles: CCOc1cc(ccc1O)c1[nH]c(=O)c2c(n1)n(nc2)c1ccccc1
STK773837
Synonyms: ethyl3-{[3-(1-benzyl-1H-indol-3-yl)propanoyl]amino}-3-(2-chlorophenyl)propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)CCc1cn(c2c1cccc2)Cc1ccccc1
STK773838
Synonyms: 4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-{2-[(4-fluorophenyl)carbonyl]-1-benzofuran-3-yl}butanamide
Smiles: O=C(Nc1c(oc2c1cccc2)C(=O)c1ccc(cc1)F)CCCN1C(=O)c2c(C1=O)cccc2
STK773839
Synonyms: ethyl1-(furan-2-ylmethyl)-2-methyl-5-oxo-4-[(phenylcarbonyl)amino]-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(C)N(C(=O)C1(NC(=O)c1ccccc1)C(F)(F)F)Cc1ccco1
STK773840
Synonyms: 4-[(3,4-dihydro-1H-isochromen-1-ylmethyl)amino]-4-oxobutanoicacid
Smiles: O=C(CCC(=O)O)NCC1OCCc2c1cccc2
STK773841
Synonyms: N-(3-bromophenyl)-2-[1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetamide
Smiles: CSc1c(CC(=O)Nc2cccc(c2)Br)n(c2c1cccc2)C
STK773842
Synonyms: 3-{[4-(3-chloro-4-methylphenyl)piperazin-1-yl]carbonyl}-8-methoxy-6-nitro-2H-chromen-2-one
Smiles: COc1cc(cc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)c1ccc(c(c1)Cl)C)[N+](=O)[O-]
STK773844
Synonyms: N-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-2-methoxy-5-methylbenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCCc1c(C)[nH]c2c1cc(F)cc2)C
STK773845
Synonyms: N-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-carboxamide
Smiles: C=CCc1cccc2c1oc(=O)c(c2)C(=O)NCCc1c(C)[nH]c2c1cccc2Cl
STK773846
Synonyms: 3-{[4-(2,5-dichlorophenyl)piperazin-1-yl]carbonyl}-8-methoxy-2H-chromen-2-one
Smiles: COc1cccc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)c1cc(Cl)ccc1Cl
STK773847
Synonyms: N-{4-[chloro(difluoro)methoxy]phenyl}-2-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OC(Cl)(F)F)CSc1nnc(n1C)c1cccnc1
STK773849
Synonyms: 4-(2,3-dichlorophenyl)-1-(2,4-difluorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Fc1ccc(c(c1)F)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccc(c1Cl)Cl
STK773852
Synonyms: 5-(propan-2-yloxy)-5-(trifluoromethyl)-3-[3-(trifluoromethyl)phenyl]imidazolidine-2,4-dione
Smiles: CC(OC1(NC(=O)N(C1=O)c1cccc(c1)C(F)(F)F)C(F)(F)F)C
STK773853
Synonyms: 1-(4-{3-[4-(2-fluorophenyl)piperazin-1-yl]-2-hydroxypropoxy}-3-methoxyphenyl)ethanone
Smiles: COc1cc(ccc1OCC(CN1CCN(CC1)c1ccccc1F)O)C(=O)C
STK773854
Synonyms: 7-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)oxy]-2H-chromen-2-one
Smiles: O=c1ccc2c(o1)cc(cc2)Oc1nc(nn1C)[N+](=O)[O-]
STK773856
Synonyms: 1-cyclooctyl-3-pyridin-3-ylthiourea
Smiles: S=C(Nc1cccnc1)NC1CCCCCCC1
STK773857
Synonyms: N-(pyridin-3-yl)piperidine-1-carbothioamide
Smiles: S=C(N1CCCCC1)Nc1cccnc1
STK773858
Synonyms: 1-pyridin-3-yl-3-(1,2,3,4-tetrahydronaphthalen-1-yl)thiourea
Smiles: S=C(NC1CCCc2c1cccc2)Nc1cccnc1
STK773860
Synonyms: 4-(diphenylmethyl)-N-(pyridin-3-yl)piperazine-1-carbothioamide
Smiles: S=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)Nc1cccnc1
STK773861
Synonyms: 1-benzyl-1-(2-phenylethyl)-3-pyridin-3-ylthiourea
Smiles: S=C(N(Cc1ccccc1)CCc1ccccc1)Nc1cccnc1
STK773862
Synonyms: 1,1'-propane-1,2-diylbis[3-(4-methoxyphenyl)(thiourea)]
Smiles: COc1ccc(cc1)NC(=S)NCC(NC(=S)Nc1ccc(cc1)OC)C
STK773864
Synonyms: 1-benzyl-1-propan-2-yl-3-pyridin-3-ylthiourea
Smiles: CC(N(C(=S)Nc1cccnc1)Cc1ccccc1)C
STK773865
Synonyms: 1,1'-pentane-1,3-diylbis[3-(4-acetylphenyl)(thiourea)]
Smiles: CCC(NC(=S)Nc1ccc(cc1)C(=O)C)CCNC(=S)Nc1ccc(cc1)C(=O)C
STK773866
Synonyms: 3a'-(4-tert-butylphenyl)dihydrodispiro[cyclopentane-1,3'-furo[3,2-b]furan-6',1''-cyclopentane]-2',5'-dione
Smiles: O=C1OC2(C(C31CCCC3)OC(=O)C12CCCC1)c1ccc(cc1)C(C)(C)C
STK773868
Synonyms: 3-(4-bromophenyl)-2-(4-methoxyphenyl)-2-azaspiro[3.5]nonan-1-one
Smiles: COc1ccc(cc1)N1C(=O)C2(C1c1ccc(cc1)Br)CCCCC2
STK773871
Synonyms: 2-(4-bromophenyl)-3-(4-methoxyphenyl)-2-azaspiro[3.4]octan-1-one
Smiles: COc1ccc(cc1)C1N(c2ccc(cc2)Br)C(=O)C21CCCC2
STK773873
Synonyms: 3-(2-chloro-4-fluorophenyl)-4,4-dimethyl-2-oxaspiro[5.5]undecane-1,5-dione
Smiles: Fc1ccc(c(c1)Cl)C1OC(=O)C2(C(=O)C1(C)C)CCCCC2
STK773875
Synonyms: 4,4-dimethyl-1-(pentafluorophenyl)-2-oxaspiro[5.5]undecane-3,5-dione
Smiles: Fc1c(F)c(c(c(c1F)F)F)C1OC(=O)C(C(=O)C21CCCCC2)(C)C
STK773876
Synonyms: 1a-acetyl-1-[(4-bromophenyl)carbonyl]-1-methyl-1a,9c-dihydrobenzo[f]cyclopropa[c]chromen-2(1H)-one
Smiles: Brc1ccc(cc1)C(=O)C1(C)C2C1(C(=O)C)C(=O)Oc1c2c2ccccc2cc1
STK773881
Synonyms: 1a-acetyl-1-methyl-1-[(4-methylphenyl)carbonyl]-1a,9c-dihydrobenzo[f]cyclopropa[c]chromen-2(1H)-one
Smiles: Cc1ccc(cc1)C(=O)C1(C)C2C1(C(=O)C)C(=O)Oc1c2c2ccccc2cc1
STK773882
Synonyms: 6-(1-acetyl-1H-indol-3-yl)-5,5-diethyl-3,3-dimethyldihydro-2H-pyran-2,4(3H)-dione
Smiles: CCC1(CC)C(OC(=O)C(C1=O)(C)C)c1cn(c2c1cccc2)C(=O)C
STK773884
Synonyms: dimethyl2-[(4-chlorophenyl)carbonyl]-2-ethyl-3-[(E)-2-(3-nitrophenyl)ethenyl]cyclopropane-1,1-dicarboxylate
Smiles: COC(=O)C1(C(=O)OC)C(C1(CC)C(=O)c1ccc(cc1)Cl)/C=C/c1cccc(c1)[N+](=O)[O-]
STK773885
Synonyms: 3,5-diphenyl-7-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: S=c1sc2c(n1c1ccccc1)nc(nc2N1CCCC1)c1ccccc1
STK773886
Synonyms: 3,5-diphenyl-7-(piperidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: S=c1sc2c(n1c1ccccc1)nc(nc2N1CCCCC1)c1ccccc1
STK773887
Synonyms: 7-(azepan-1-yl)-3,5-diphenyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: S=c1sc2c(n1c1ccccc1)nc(nc2N1CCCCCC1)c1ccccc1
STK773888
Synonyms: 1'-methyl-6'-nitro-2,3'-biquinolin-4'(1'H)-one
Smiles: O=c1c(cn(c2c1cc(cc2)[N+](=O)[O-])C)c1ccc2c(n1)cccc2
STK773890
Synonyms: 8,8'-(methanediyldisulfanediyl)bis(7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione)
Smiles: CCn1c(SCSc2nc3c(n2CC)c(=O)n(c(=O)n3C)C)nc2c1c(=O)n(c(=O)n2C)C
STK773892
Synonyms: 5,5'-[ethane-1,2-diylbis(oxy)]bis(1-phenyl-1H-tetrazole)
Smiles: c1ccc(cc1)n1nnnc1OCCOc1nnnn1c1ccccc1
STK773893
Synonyms: 1-(2-bromoethyl)-4-(3-chlorophenyl)-1,4-dihydro-5H-tetrazol-5-one
Smiles: BrCCn1nnn(c1=O)c1cccc(c1)Cl
STK773894
Synonyms: 4-methyl-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Cn1c(S)nnc1c1ccc2c(n1)cccc2
STK773895
Synonyms: 4-(4-chlorophenyl)-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)n1c(S)nnc1c1ccc2c(n1)cccc2
STK773896
Synonyms: 5-(quinolin-2-yl)-4-[2-(trifluoromethyl)phenyl]-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1c1ccccc1C(F)(F)F)c1ccc2c(n1)cccc2
STK773897
Synonyms: 3-[4-(2,5-dimethoxyphenyl)-5-sulfanyl-4H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4(1H)-one
Smiles: COc1ccc(cc1n1c(S)nnc1c1cn(CC)c2c(c1=O)ccc(n2)C)OC
STK773902
Synonyms: 1-[(2,5-dimethylthiophen-3-yl)sulfonyl]-4-phenylpiperazine
Smiles: Cc1sc(c(c1)S(=O)(=O)N1CCN(CC1)c1ccccc1)C
STK773904
Synonyms: 1-(2,4-dimethylphenyl)-5-[(2-fluorobenzyl)sulfanyl]-1H-tetrazole
Smiles: Cc1ccc(c(c1)C)n1nnnc1SCc1ccccc1F
STK773905
Synonyms: N-(3,4-difluorophenyl)-2-{[1,3-dimethyl-7-(2-methylbenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)F)CSc1nc2c(n1Cc1ccccc1C)c(=O)n(c(=O)n2C)C
STK773906
Synonyms: N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl}furan-2-carboxamide
Smiles: COc1cc(CCN2C3=C(C(C2=O)(NC(=O)c2ccco2)C(F)(F)F)C(=O)CC(C3)(C)C)ccc1OC
STK773907
Synonyms: N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}furan-2-carboxamide
Smiles: COc1cc(ccc1OC)CCn1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)c1ccco1)C(F)(F)F
STK773908
Synonyms: N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}-4-methylbenzamide
Smiles: COc1ccc(cc1OC)CCn1c(=O)[nH]c(=O)c2c1NC(=O)C2(NC(=O)c1ccc(cc1)C)C(F)(F)F
STK773910
Synonyms: 4-[1-(3-methoxy-4-methylbenzyl)-1H-benzimidazol-2-yl]-1,2,5-oxadiazol-3-amine
Smiles: COc1cc(ccc1C)Cn1c(nc2c1cccc2)c1nonc1N
STK773911
Synonyms: N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl}-2-fluorobenzamide
Smiles: COc1ccc(cc1OC)CCN1C(=O)NC(C1=O)(NC(=O)c1ccccc1F)C(F)(F)F
STK773912
Synonyms: 2-(piperidin-1-yl)-6-(propan-2-yloxy)-4,4-bis(trifluoromethyl)-4H-1,3,5-oxadiazine
Smiles: CC(OC1=NC(N=C(O1)N1CCCCC1)(C(F)(F)F)C(F)(F)F)C
STK773913
Synonyms: 3,4-dimethoxy-N-[1-methyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]benzamide
Smiles: COc1cc(ccc1OC)C(=O)NC1(NC(=O)N(C1=O)C)C(F)(F)F
STK773914
Synonyms: 2-{[5-oxo-6-(trifluoromethyl)-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-6-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)NC1(N=C2N(C1=O)CCS2)C(F)(F)F
STK773915
Synonyms: 6-[(5-methylpyridin-2-yl)amino]-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5(6H)-one
Smiles: Cc1ccc(nc1)NC1(N=C2N(C1=O)CCS2)C(F)(F)F
STK773916
Synonyms: 2-{[5-oxo-2-phenyl-4-(trifluoromethyl)-4,5-dihydro-1H-imidazol-4-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)NC1(N=C(NC1=O)c1ccccc1)C(F)(F)F
STK773918
Synonyms: methyl6-chloro-3-fluoroimidazo[1,2-a]pyridine-2-carboxylate
Smiles: COC(=O)c1nc2n(c1F)cc(cc2)Cl
STK773922
Synonyms: N-{1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-5-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-pyrrolo[2,3-d]pyrimidin-5-yl}propanamide
Smiles: CCC(=O)NC1(C(=O)Nc2c1c(=O)[nH]c(=O)n2CCc1ccc(c(c1)OC)OC)C(F)(F)F
STK773923
Synonyms: 1-(4-bromo-2-fluorophenyl)-3-pyridin-3-ylthiourea
Smiles: S=C(Nc1ccc(cc1F)Br)Nc1cccnc1
STK773924
Synonyms: 1-(2-bromophenyl)-3-pyridin-3-ylthiourea
Smiles: S=C(Nc1ccccc1Br)Nc1cccnc1
STK773925
Synonyms: 1-(cyclopropylmethyl)-3-(2-methoxyphenyl)-1-propylthiourea
Smiles: CCCN(C(=S)Nc1ccccc1OC)CC1CC1
STK773926
Synonyms: 1-(2-bromo-4-methylphenyl)-3-pyridin-3-ylthiourea
Smiles: S=C(Nc1ccc(cc1Br)C)Nc1cccnc1
STK773927
Synonyms: 1-cyclohexyl-3-(3,4-dimethylphenyl)-1-(3-{[(3,4-dimethylphenyl)carbamothioyl]amino}propyl)thiourea(non-preferredname)
Smiles: S=C(Nc1ccc(c(c1)C)C)NCCCN(C(=S)Nc1ccc(c(c1)C)C)C1CCCCC1
STK773928
Synonyms: 1-(4-phenylbutan-2-yl)-3-pyridin-3-ylthiourea
Smiles: CC(NC(=S)Nc1cccnc1)CCc1ccccc1
STK773930
Synonyms: N-(2-cyano-4,5-diethoxyphenyl)-4-methoxy-3-[(4-methylpiperidin-1-yl)sulfonyl]benzamide
Smiles: CCOc1cc(NC(=O)c2ccc(c(c2)S(=O)(=O)N2CCC(CC2)C)OC)c(cc1OCC)C#N
STK773931
Synonyms: 3-(azepan-1-ylsulfonyl)-N-(2-cyano-4,5-diethoxyphenyl)-4-methoxybenzamide
Smiles: CCOc1cc(NC(=O)c2ccc(c(c2)S(=O)(=O)N2CCCCCC2)OC)c(cc1OCC)C#N
STK773932
Synonyms: 2-chloro-5-[(6-cyano-1,3-benzodioxol-5-yl)sulfamoyl]-N-(4-nitrophenyl)benzamide
Smiles: N#Cc1cc2OCOc2cc1NS(=O)(=O)c1ccc(c(c1)C(=O)Nc1ccc(cc1)[N+](=O)[O-])Cl
STK773933
Synonyms: 1-acetyl-N-(6-cyano-1,3-benzodioxol-5-yl)-2,3-dihydro-1H-indole-6-sulfonamide
Smiles: N#Cc1cc2OCOc2cc1NS(=O)(=O)c1ccc2c(c1)N(CC2)C(=O)C
STK773934
Synonyms: 2-(4-bromophenyl)-2-oxoethyl3-phenyl-4-[(phenylsulfonyl)amino]butanoate
Smiles: O=C(CC(c1ccccc1)CNS(=O)(=O)c1ccccc1)OCC(=O)c1ccc(cc1)Br
STK773935
Synonyms: N-{5-[(4-chlorophenoxy)methyl]-1,3,4-thiadiazol-2-yl}-4-[methyl(phenylsulfonyl)amino]-3-phenylbutanamide
Smiles: O=C(CC(c1ccccc1)CN(S(=O)(=O)c1ccccc1)C)Nc1nnc(s1)COc1ccc(cc1)Cl
STK773936
Synonyms: 4-[methyl(phenylsulfonyl)amino]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-phenylbutanamide
Smiles: O=C(CC(c1ccccc1)CN(S(=O)(=O)c1ccccc1)C)Nc1nnc(s1)C
STK773939
Synonyms: 4-{[(4-bromophenyl)sulfonyl](methyl)amino}-3-phenyl-N-(1,3,4-thiadiazol-2-yl)butanamide
Smiles: O=C(CC(c1ccccc1)CN(S(=O)(=O)c1ccc(cc1)Br)C)Nc1nncs1
STK773940
Synonyms: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-[(2-oxo-4-phenylpyrrolidin-1-yl)sulfonyl]benzamide
Smiles: O=C1CC(CN1S(=O)(=O)c1cccc(c1)C(=O)Nc1nnc(s1)C1CC1)c1ccccc1
STK773942
Synonyms: 3-[(2-oxo-4-phenylpyrrolidin-1-yl)sulfonyl]-N-(1,3,4-thiadiazol-2-yl)benzamide
Smiles: O=C1CC(CN1S(=O)(=O)c1cccc(c1)C(=O)Nc1nncs1)c1ccccc1
STK773943
Synonyms: N-(5-methyl-1,2-oxazol-3-yl)-3-[(2-oxo-4-phenylpyrrolidin-1-yl)sulfonyl]benzamide
Smiles: O=C1CC(CN1S(=O)(=O)c1cccc(c1)C(=O)Nc1noc(c1)C)c1ccccc1
STK773944
Synonyms: N-(4-chlorophenyl)-3-[(2-oxo-4-phenylpyrrolidin-1-yl)sulfonyl]benzamide
Smiles: Clc1ccc(cc1)NC(=O)c1cccc(c1)S(=O)(=O)N1CC(CC1=O)c1ccccc1
STK773946
Synonyms: 4-methoxy-3-[(2-oxo-4-phenylpyrrolidin-1-yl)sulfonyl]-N-phenylbenzamide
Smiles: COc1ccc(cc1S(=O)(=O)N1CC(CC1=O)c1ccccc1)C(=O)Nc1ccccc1
STK773947
Synonyms: N-(4-chlorophenyl)-4-methoxy-3-[(2-oxo-4-phenylpyrrolidin-1-yl)sulfonyl]benzamide
Smiles: COc1ccc(cc1S(=O)(=O)N1CC(CC1=O)c1ccccc1)C(=O)Nc1ccc(cc1)Cl
STK773950
Synonyms: N-[4-(cyanomethyl)phenyl]-2-(3-methoxyphenoxy)acetamide
Smiles: N#CCc1ccc(cc1)NC(=O)COc1cccc(c1)OC
STK773951
Synonyms: 2,4-dichloro-N-(6-cyano-1,3-benzodioxol-5-yl)-5-(morpholin-4-ylsulfonyl)benzamide
Smiles: N#Cc1cc2OCOc2cc1NC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)N1CCOCC1
STK773952
Synonyms: 2,4-dichloro-N-(2-cyano-4,5-diethoxyphenyl)-5-(morpholin-4-ylsulfonyl)benzamide
Smiles: CCOc1cc(NC(=O)c2cc(c(cc2Cl)Cl)S(=O)(=O)N2CCOCC2)c(cc1OCC)C#N
STK773953
Synonyms: 2-amino-4-(2,3-dimethoxyphenyl)-1-(dimethylamino)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cccc(c1OC)OC)C(=O)CC(C2)c1ccccc1
STK773954
Synonyms: 2-amino-1-(dimethylamino)-4-(2-fluorophenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1ccccc1F)C(=O)CC(C2)c1ccccc1
STK773955
Synonyms: 2-amino-1-(dimethylamino)-4-(2-ethoxyphenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: CCOc1ccccc1C1C2=C(CC(CC2=O)c2ccccc2)N(C(=C1C#N)N)N(C)C
STK773956
Synonyms: 2-amino-4-(2,3-dichlorophenyl)-1-(dimethylamino)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cccc(c1Cl)Cl)C(=O)CC(C2)c1ccccc1
STK773957
Synonyms: 2-amino-4-(2-chloro-6-fluorophenyl)-1-(dimethylamino)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1c(F)cccc1Cl)C(=O)CC(C2)c1ccccc1
STK773958
Synonyms: 2-amino-1-(dimethylamino)-4-(3-methylphenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1c1cccc(c1)C)C(=O)CC(C2)c1ccccc1)N(C)C
STK773959
Synonyms: 2-amino-1-(dimethylamino)-5-oxo-7-phenyl-4-(2,3,4-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc(c(c1OC)OC)OC)C(=O)CC(C2)c1ccccc1
STK773960
Synonyms: 2-amino-1-(dimethylamino)-5-oxo-7-phenyl-4-[4-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc(cc1)C(F)(F)F)C(=O)CC(C2)c1ccccc1
STK773961
Synonyms: 2-amino-4-(1,3-benzodioxol-5-yl)-1-(dimethylamino)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)c1ccccc1
STK773962
Synonyms: 2-amino-1-(dimethylamino)-4-(3-methylthiophen-2-yl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1sccc1C)C(=O)CC(C2)c1ccccc1
STK773963
Synonyms: 2-amino-1-(dimethylamino)-5-oxo-4-[4-(prop-2-en-1-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: C=CCOc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CCC2)N(C)C)C#N
STK773964
Synonyms: (4Z)-2-(naphthalen-2-yl)-4-[(2E)-3-(4-nitrophenyl)prop-2-en-1-ylidene]-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\C=C\c1ccc(cc1)[N+](=O)[O-])c1ccc2c(c1)cccc2
STK773965
Synonyms: 5-methoxy-2-(6'-methoxy-1',3',4',9a'-tetrahydrospiro[cyclohexane-1,9'-xanthen]-4a'(2'H)-yl)phenylthiophene-2-carboxylate
Smiles: COc1ccc(c(c1)OC(=O)c1cccs1)C12CCCCC2C2(c3c(O1)cc(OC)cc3)CCCCC2
STK773966
Synonyms: 6-chloro-6',6'-dimethyl-2'-(prop-2-en-1-ylsulfanyl)-4-(thiophen-2-yl)-3,4,5',6'-tetrahydro-3'H-spiro[chromene-2,4'-pyrimidin]-7-ol
Smiles: C=CCSC1=NC(CC2(N1)Oc1cc(O)c(cc1C(C2)c1cccs1)Cl)(C)C
STK773970
Synonyms: 6-[(E)-2-(2-fluorophenyl)ethenyl]-4,4-dimethyl-3,4-dihydropyrimidine-2(1H)-thione
Smiles: S=C1NC(=CC(N1)(C)C)/C=C/c1ccccc1F
STK773971
Synonyms: 1-(6-methoxy-1,3-benzothiazol-2-yl)-3-(4-methylbenzyl)pyrrolidine-2,5-dione
Smiles: COc1ccc2c(c1)sc(n2)N1C(=O)CC(C1=O)Cc1ccc(cc1)C
STK773972
Synonyms: N-[3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)phenyl]acetamide
Smiles: CC(=O)Nc1cccc(c1)N1C(=O)C2C(C1=O)C1CC2C=C1
STK773973
Synonyms: methyl5-chloro-3-[(phenylcarbonyl)amino]-1-benzofuran-2-carboxylate
Smiles: COC(=O)c1oc2c(c1NC(=O)c1ccccc1)cc(cc2)Cl
STK773974
Synonyms: 4-[6'-(acetyloxy)-1',3',4',9a'-tetrahydrospiro[cyclohexane-1,9'-xanthen]-4a'(2'H)-yl]benzene-1,3-diyldiacetate
Smiles: CC(=O)Oc1ccc(c(c1)OC(=O)C)C12CCCCC2C2(c3c(O1)cc(cc3)OC(=O)C)CCCCC2
STK773976
Synonyms: 4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Sc1nnc(n1Cc1ccccc1)c1ccc2c(n1)cccc2
STK773978
Synonyms: 4-(4-chlorophenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol
Smiles: Clc1ccc(cc1)n1c(S)nnc1c1cccnc1
STK773979
Synonyms: methyl6-[(4-bromophenyl)carbonyl]-6-ethyl-4,4-dimethyl-2-oxo-3-oxabicyclo[3.1.0]hexane-1-carboxylate
Smiles: COC(=O)C12C(=O)OC(C1C2(CC)C(=O)c1ccc(cc1)Br)(C)C
STK773980
Synonyms: methyl6-[(4-chlorophenyl)carbonyl]-6-ethyl-4,4-dimethyl-2-oxo-3-oxabicyclo[3.1.0]hexane-1-carboxylate
Smiles: COC(=O)C12C(=O)OC(C1C2(CC)C(=O)c1ccc(cc1)Cl)(C)C
STK773981
Synonyms: 1-methyl-1,1a-bis(phenylcarbonyl)-1a,9c-dihydrobenzo[f]cyclopropa[c]chromen-2(1H)-one
Smiles: O=C(C1(C)C2C1(C(=O)Oc1c2c2ccccc2cc1)C(=O)c1ccccc1)c1ccccc1
STK773982
Synonyms: dimethyl2-methyl-2-[(4-methylphenyl)carbonyl]-3-[(E)-2-(3-nitrophenyl)ethenyl]cyclopropane-1,1-dicarboxylate
Smiles: COC(=O)C1(C(=O)OC)C(C1(C)C(=O)c1ccc(cc1)C)/C=C/c1cccc(c1)[N+](=O)[O-]
STK773983
Synonyms: 1-[(4-chlorophenyl)carbonyl]-1-ethyl-1a-(phenylcarbonyl)-1a,9c-dihydrobenzo[f]cyclopropa[c]chromen-2(1H)-one
Smiles: CCC1(C(=O)c2ccc(cc2)Cl)C2C1(C(=O)Oc1c2c2ccccc2cc1)C(=O)c1ccccc1
STK773984
Synonyms: 2-(4-chloro-2-methylphenoxy)-N-(2,5-dimethyl-1H-pyrrol-1-yl)acetamide
Smiles: O=C(Nn1c(C)ccc1C)COc1ccc(cc1C)Cl
STK773985
Synonyms: (4E)-2-(3-methylphenyl)-4-[(2E)-3-(4-nitrophenyl)prop-2-en-1-ylidene]-1,3-oxazol-5(4H)-one
Smiles: Cc1cccc(c1)C1=N/C(=C/C=C/c2ccc(cc2)[N+](=O)[O-])/C(=O)O1
STK773986
Synonyms: (5E)-2-(2-chlorophenyl)-5-(4-methoxybenzylidene)-3,5-dihydro-4H-imidazol-4-one
Smiles: COc1ccc(cc1)/C=C\1/N=C(NC1=O)c1ccccc1Cl
STK773987
Synonyms: 2-[4-(cyanomethyl)piperazin-1-yl]-N-(naphthalen-1-yl)acetamide
Smiles: N#CCN1CCN(CC1)CC(=O)Nc1cccc2c1cccc2
STK773988
Synonyms: 2-ethoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenylbenzoate
Smiles: CCOc1cc(ccc1OC(=O)c1ccccc1)C1Nc2ccc3c(c2C2=C1C(=O)CCC2)cccc3
STK773989
Synonyms: 2-ethoxy-4-(4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)phenylacetate
Smiles: CCOc1cc(ccc1OC(=O)C)C1Nc2ccc3c(c2C2=C1C(=O)CCC2)cccc3
STK773990
Synonyms: 4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2-ethoxyphenyl2-methylpropanoate
Smiles: CCOc1cc(ccc1OC(=O)C(C)C)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3
STK773991
Synonyms: 5-(4-ethoxyphenyl)-2-phenyl-2,3,5,6-tetrahydro-4H-benzo[f]pyrano[3,2-c]quinolin-4-one
Smiles: CCOc1ccc(cc1)C1Nc2ccc3c(c2C2=C1C(=O)CC(O2)c1ccccc1)cccc3
STK773992
Synonyms: 4-[(3-iodobenzyl)oxy]benzaldehyde
Smiles: O=Cc1ccc(cc1)OCc1cccc(c1)I
STK773993
Synonyms: N-cyclopropyl-3-methyl-4-(1H-tetrazol-1-yl)benzenesulfonamide
Smiles: Cc1cc(ccc1n1cnnn1)S(=O)(=O)NC1CC1
STK773994
Synonyms: 2-[4-(2-nitrophenyl)piperazin-1-yl]-5-(propan-2-ylidene)-1,3-thiazol-4(5H)-one
Smiles: CC(=C1SC(=NC1=O)N1CCN(CC1)c1ccccc1[N+](=O)[O-])C
STK773997
Synonyms: 7-(3,4-dimethoxyphenyl)-1,3-dimethyl-8-(4-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(ccc1OC)c1cn2c(n1c1ccc(cc1)C)nc1c2c(=O)n(C)c(=O)n1C
STK773998
Synonyms: 7-(3,4-dimethoxyphenyl)-8-(4-methoxyphenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1ccc(cc1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(c(c1)OC)OC
STK773999
Synonyms: 7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(ccc1OC)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1
STK774002
Synonyms: 1,1'-(5,6,11,12,17,18,23,24-octahydro-7,10:19,22-diethenodibenzo[a,k][20]annulene-8,20-diyl)diethanone
Smiles: CC(=O)c1cc2ccc1CCc1ccccc1CCc1ccc(CCc3c(CC2)cccc3)c(c1)C(=O)C
STK774003
Synonyms: 4-(cyclopentyloxy)-3-methoxybenzaldehyde
Smiles: COc1cc(C=O)ccc1OC1CCCC1
STK774004
Synonyms: 3-(4-fluorobenzyl)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-1H-indole
Smiles: Cc1ccc(cc1)S(=O)(=O)n1cc(c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-])Cc1ccc(cc1)F
STK774005
Synonyms: (3Z)-3-(4-methoxybenzylidene)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Smiles: COc1ccc(cc1)/C=C/1\CN(c2c1c(cc(c2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)c1ccc(cc1)C
STK774006
Synonyms: N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]benzene-1,2-diamine
Smiles: Nc1ccccc1/N=c/1\ssnc1Cl
STK774007
Synonyms: N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]-2-methoxy-4-nitroaniline
Smiles: COc1cc(ccc1/N=c/1\ssnc1Cl)[N+](=O)[O-]
STK774008
Synonyms: 4-chloro-N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]-2,5-dimethoxyaniline
Smiles: COc1cc(Cl)c(cc1/N=c/1\ssnc1Cl)OC
STK774009
Synonyms: N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]-4-nitronaphthalen-1-amine
Smiles: [O-][N+](=O)c1ccc(c2c1cccc2)/N=c/1\ssnc1Cl
STK774010
Synonyms: N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]-4-methyl-2-nitroaniline
Smiles: Cc1ccc(c(c1)[N+](=O)[O-])/N=c/1\ssnc1Cl
STK774011
Synonyms: 4-{[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]amino}benzonitrile
Smiles: N#Cc1ccc(cc1)/N=c/1\ssnc1Cl
STK774012
Synonyms: 4-bromo-N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]aniline
Smiles: Brc1ccc(cc1)/N=c/1\ssnc1Cl
STK774013
Synonyms: N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]-4-methyl-3-nitroaniline
Smiles: [O-][N+](=O)c1cc(ccc1C)/N=c/1\ssnc1Cl
STK774014
Synonyms: N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]-3,4,5-trimethoxyaniline
Smiles: COc1cc(cc(c1OC)OC)/N=c/1\ssnc1Cl
STK774015
Synonyms: N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]-4-methylaniline
Smiles: Cc1ccc(cc1)/N=c/1\ssnc1Cl
STK774016
Synonyms: N-[(5Z)-4-chloro-5H-1,2,3-dithiazol-5-ylidene]aniline
Smiles: Clc1nss/c/1=N\c1ccccc1
STK774018
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)c1cc(OC)c(c(c1)OC)OC
STK774019
Synonyms: ethyl3-(4-methylphenyl)-3-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NC(=O)c1cc(OC)c(c(c1)OC)OC
STK774020
Synonyms: 2,5-bis(3-methoxyphenyl)[1,3]thiazolo[5,4-d][1,3]thiazole
Smiles: COc1cccc(c1)c1nc2c(s1)nc(s2)c1cccc(c1)OC
STK774023
Synonyms: 3-(5-bromofuran-2-yl)-5-[(4-chlorophenoxy)methyl]-1,2,4-oxadiazole
Smiles: Clc1ccc(cc1)OCc1onc(n1)c1ccc(o1)Br
STK774030
Synonyms: N-(2-{[(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino}phenyl)-4-(trifluoromethyl)benzamide
Smiles: O=C(Nc1ccccc1NC(=O)c1ccc(cc1)C(F)(F)F)CSc1nc2c(s1)cccc2
STK774031
Synonyms: 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N-(6-cyano-1,3-benzodioxol-5-yl)acetamide
Smiles: N#Cc1cc2OCOc2cc1NC(=O)Cn1c(nc2c1cccc2)c1nonc1N
STK774032
Synonyms: cyclohexylmethyl6-(2,5-dimethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1ccc(cc1C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OCC1CCCCC1)OC
STK774033
Synonyms: 8-(4-butanoylphenoxy)-1,3-dimethyl-7-(2-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCC(=O)c1ccc(cc1)Oc1nc2c(n1Cc1ccccc1C)c(=O)n(c(=O)n2C)C
STK774035
Synonyms: N-(pyridin-3-yl)-2,3-dihydro-1H-indole-1-carbothioamide
Smiles: S=C(N1CCc2c1cccc2)Nc1cccnc1
STK774036
Synonyms: 1-(diphenylmethyl)-3-pyridin-3-ylthiourea
Smiles: S=C(NC(c1ccccc1)c1ccccc1)Nc1cccnc1
STK774037
Synonyms: 1-(cyclopropylmethyl)-3-(2,3-dimethylphenyl)-1-propylthiourea
Smiles: CCCN(C(=S)Nc1cccc(c1C)C)CC1CC1
STK774038
Synonyms: 1-(4-acetylphenyl)-3-[4-(morpholin-4-yl)phenyl]thiourea
Smiles: S=C(Nc1ccc(cc1)C(=O)C)Nc1ccc(cc1)N1CCOCC1
STK774039
Synonyms: N-(4-acetylphenyl)-2-(7-chloroquinolin-4-yl)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1)C(=O)C)NNc1ccnc2c1ccc(c2)Cl
STK774040
Synonyms: N-(2-cyano-4,5-diethoxyphenyl)-4-(2,4-dichlorophenoxy)butanamide
Smiles: CCOc1cc(NC(=O)CCCOc2ccc(cc2Cl)Cl)c(cc1OCC)C#N
STK774042
Synonyms: 2-amino-1-(dimethylamino)-5-oxo-7-phenyl-4-(2,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cc(OC)c(cc1OC)OC)C(=O)CC(C2)c1ccccc1
STK774043
Synonyms: 2-amino-1-(dimethylamino)-4-(naphthalen-1-yl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cccc3c1cccc3)C(=O)CC(C2)c1ccccc1
STK774044
Synonyms: 2-amino-1-(dimethylamino)-4-(naphthalen-2-yl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc3c(c1)cccc3)C(=O)CC(C2)c1ccccc1
STK774045
Synonyms: 2-amino-1-(dimethylamino)-4-[5-ethyl-2-(ethylsulfanyl)thiophen-3-yl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: CCSc1sc(cc1C1C2=C(CC(CC2=O)c2ccccc2)N(C(=C1C#N)N)N(C)C)CC
STK774046
Synonyms: 2-amino-1-(dimethylamino)-5-oxo-7-phenyl-4-[4-(prop-2-en-1-yloxy)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: C=CCOc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CC(C2)c1ccccc1)N(C)C)C#N
STK774048
Synonyms: isoquinoline-1-carbonitrile
Smiles: N#Cc1nccc2c1cccc2
STK774049
Synonyms: 2-chloro-1-(5H-dibenzo[b,f]azepin-5-yl)ethanone
Smiles: ClCC(=O)N1c2ccccc2C=Cc2c1cccc2
STK774050
Synonyms: methyl5-chloro-1H-1,2,3-triazole-4-carboxylate
Smiles: COC(=O)c1nn[nH]c1Cl
STK774051
Synonyms: 4-[(2,2-dimethyl-1,2-dihydrobenzo[f]isoquinolin-4-yl)sulfanyl]aniline
Smiles: Nc1ccc(cc1)SC1=NC(C)(C)Cc2c1ccc1c2cccc1
STK774053
Synonyms: 3-methylhept-1-yn-3-ol
Smiles: CC(C#C)(CCCC)O
STK774054
Synonyms: (1-ethoxyethylidene)propanedinitrile
Smiles: CCOC(=C(C#N)C#N)C
STK774055
Synonyms: 5-amino-N-(3-chloro-4-fluorophenyl)-3-ethyl-1,2-oxazole-4-carboxamide
Smiles: CCc1noc(c1C(=O)Nc1ccc(c(c1)Cl)F)N
STK774058
Synonyms: 1-(3-methyl-4-thioxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl)ethanone
Smiles: S=C1Nc2ccccc2N(CC1C)C(=O)C
STK774059
Synonyms: N-[4-(acetylamino)-1,2,5-oxadiazol-3-yl]-2-(pyridin-2-ylsulfanyl)acetamide
Smiles: O=C(Nc1nonc1NC(=O)C)CSc1ccccn1
STK774062
Synonyms: N-(3,4-dichlorophenyl)-N'-(pyridin-3-yl)hydrazine-1,2-dicarbothioamide
Smiles: S=C(Nc1ccc(c(c1)Cl)Cl)NNC(=S)Nc1cccnc1
STK774063
Synonyms: 1-(2-chlorophenyl)-3-(6-methoxypyridin-3-yl)thiourea
Smiles: COc1ccc(cn1)NC(=S)Nc1ccccc1Cl
STK774064
Synonyms: 1-(2,4-dichlorophenyl)-3-(3-phenoxyphenyl)thiourea
Smiles: S=C(Nc1ccc(cc1Cl)Cl)Nc1cccc(c1)Oc1ccccc1
STK774065
Synonyms: 3-(5-bromofuran-2-yl)-5-[(4-chloro-3,5-dimethylphenoxy)methyl]-1,2,4-oxadiazole
Smiles: Brc1ccc(o1)c1noc(n1)COc1cc(C)c(c(c1)C)Cl
STK774066
Synonyms: (3Z)-3-(3,4-dimethoxybenzylidene)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Smiles: COc1ccc(cc1OC)/C=C/1\CN(c2c1c(cc(c2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)c1ccc(cc1)C
STK774067
Synonyms: methyl4-[({[(Z)-amino(1,5-dimethyl-1H-pyrrol-2-yl)methylidene]amino}oxy)carbonyl]benzoate
Smiles: COC(=O)c1ccc(cc1)C(=O)O/N=C(/c1ccc(n1C)C)\N
STK774068
Synonyms: N'-{[(2-methoxyphenyl)acetyl]oxy}-1,5-dimethyl-1H-pyrrole-2-carboximidamide
Smiles: COc1ccccc1CC(=O)O/N=C(\c1ccc(n1C)C)/N
STK774069
Synonyms: N-(pyridin-3-yl)-2-(2,4,6-trichlorophenyl)hydrazinecarbothioamide
Smiles: S=C(Nc1cccnc1)NNc1c(Cl)cc(cc1Cl)Cl
STK774070
Synonyms: 3-(5-bromofuran-2-yl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazole
Smiles: COc1cc(cc(c1OC)OC)c1onc(n1)c1ccc(o1)Br
STK774071
Synonyms: 3-(5-bromofuran-2-yl)-5-(5-chloro-2-methoxyphenyl)-1,2,4-oxadiazole
Smiles: COc1ccc(cc1c1onc(n1)c1ccc(o1)Br)Cl
STK774074
Synonyms: methyl2-amino-4-(2-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C1c1ccccc1F)oc(cc2=O)CO
STK774075
Synonyms: propan-2-yl2-amino-6-(hydroxymethyl)-8-oxo-4-(pyridin-3-yl)-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: OCc1cc(=O)c2c(o1)C(c1cccnc1)C(=C(O2)N)C(=O)OC(C)C
STK774076
Synonyms: 2-amino-6-(hydroxymethyl)-4-(6-nitro-1,3-benzodioxol-5-yl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc3OCOc3cc1[N+](=O)[O-])oc(cc2=O)CO
STK774077
Synonyms: 2-amino-4-(4,5-dimethoxy-2-nitrophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc(OC)c(cc1[N+](=O)[O-])OC)oc(cc2=O)CO
STK774078
Synonyms: 2-amino-6-(hydroxymethyl)-8-oxo-4-[4-(propan-2-yloxy)phenyl]-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)OC(C)C)oc(cc2=O)CO
STK774079
Synonyms: 2-amino-6-(hydroxymethyl)-4-[3-methoxy-4-(propan-2-yloxy)phenyl]-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC(C)C)oc(cc2=O)CO
STK774080
Synonyms: 2-methoxyethyl2-amino-4-(4-chlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: COCCOC(=O)C1=C(N)Oc2c(C1c1ccc(cc1)Cl)oc(cc2=O)CO
STK774081
Synonyms: ethyl2-amino-6-(hydroxymethyl)-8-oxo-4-[2-(trifluoromethyl)phenyl]-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccccc1C(F)(F)F)oc(cc2=O)CO
STK774082
Synonyms: 2-amino-4-{2-[(2-chlorobenzyl)oxy]phenyl}-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Smiles: OCc1cc(=O)c2c(o1)C(C(=C(O2)N)C#N)c1ccccc1OCc1ccccc1Cl
STK774083
Synonyms: 2-amino-4-{2-[(4-chlorobenzyl)oxy]phenyl}-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1OCc1ccc(cc1)Cl)oc(cc2=O)CO
STK774084
Synonyms: 2-amino-4-(2,5-dimethoxyphenyl)-1-(dimethylamino)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(c(c1)C1C2=C(CC(CC2=O)c2ccccc2)N(C(=C1C#N)N)N(C)C)OC
STK774085
Synonyms: 2'-amino-6'-(hydroxymethyl)-2,8'-dioxo-1,2-dihydro-8'H-spiro[indole-3,4'-pyrano[3,2-b]pyran]-3'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31C(=O)Nc1c3cccc1)oc(cc2=O)CO
STK774086
Synonyms: 2-amino-7,9-dimethyl-2',3',5',6'-tetrahydrospiro[pyrano[2',3':4,5]thieno[2,3-b]pyridine-4,4'-thiopyran]-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31CCSCC3)sc1c2c(C)cc(n1)C
STK774088
Synonyms: 7-amino-5-(3,4-dimethoxyphenyl)-4-oxo-1,5-dihydro-4H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC)c(=O)nc[nH]2
STK774090
Synonyms: 2-amino-1-(dimethylamino)-5-oxo-7-phenyl-4-(3,4,5-trimethoxyphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cc(OC)c(c(c1)OC)OC)C(=O)CC(C2)c1ccccc1
STK774091
Synonyms: 1-(2,4-dichlorobenzyl)-3-pyridin-3-ylthiourea
Smiles: S=C(Nc1cccnc1)NCc1ccc(cc1Cl)Cl
STK774092
Synonyms: 7-(dimethylamino)-3,5-diphenyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: S=c1sc2c(n1c1ccccc1)nc(nc2N(C)C)c1ccccc1
STK774093
Synonyms: 7-(dipropylamino)-3,5-diphenyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCN(c1nc(nc2c1sc(=S)n2c1ccccc1)c1ccccc1)CCC
STK774095
Synonyms: 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-[(E)-{5-[4-(trifluoromethoxy)phenyl]furan-2-yl}methylidene]acetohydrazide
Smiles: O=C(Cn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C/c1ccc(o1)c1ccc(cc1)OC(F)(F)F
STK774100
Synonyms: ethyl4,6-dibromo-5-methoxy-2-methyl-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1c(Br)c(c(c2)Br)OC
STK774101
Synonyms: 1'-methyl-9-(morpholin-4-yl)-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1NC(=O)C2(C(=O)N1C)Cc1cc([N+](=O)[O-])c(cc1N1C2COCC1)N1CCOCC1
STK774102
Synonyms: 9-(morpholin-4-yl)-8-nitro-1'-phenyl-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione
Smiles: O=C1NC(=O)C2(C(=O)N1c1ccccc1)Cc1cc([N+](=O)[O-])c(cc1N1C2COCC1)N1CCOCC1
STK774104
Synonyms: (1R,2R,5S)-2-[4-(4-methylphenyl)-5-thioxo-4,5-dihydro-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)n1nnn(c1=S)c1ccc(cc1)C
STK774105
Synonyms: (2Z)-2-{(1R,2R,5S)-2-[4-(prop-2-en-1-yl)-5-thioxo-4,5-dihydro-1H-tetrazol-1-yl]-6,8-dioxabicyclo[3.2.1]oct-4-ylidene}hydrazinecarbothioamide(non-preferredname)
Smiles: NC(=S)N/N=C\1/C[C@H]([C@H]2O[C@@H]1OC2)n1nnn(c1=S)CC=C
STK774106
Synonyms: (2E)-2-{(1R,2R,5S)-2-[4-(3-chlorophenyl)-5-thioxo-4,5-dihydro-1H-tetrazol-1-yl]-6,8-dioxabicyclo[3.2.1]oct-4-ylidene}hydrazinecarbothioamide(non-preferredname)
Smiles: NC(=S)N/N=C/1\C[C@H]([C@H]2O[C@@H]1OC2)n1nnn(c1=S)c1cccc(c1)Cl
STK774107
Synonyms: 1-(4-bromo-2-chlorophenyl)-7,7-dimethyl-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Brc1ccc(c(c1)Cl)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccnc1
STK774110
Synonyms: 2-amino-1-(dimethylamino)-4-(3-nitrophenyl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)c1ccccc1
STK774111
Synonyms: 2-amino-1-(dimethylamino)-4-(4-hydroxy-3-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc(c(c1)OC)O)C(=O)CC(C2)(C)C
STK774112
Synonyms: methyl4-[(2,4-difluorophenyl)amino]-2-oxo-6-phenylcyclohex-3-ene-1-carboxylate
Smiles: COC(=O)C1C(=O)C=C(CC1c1ccccc1)Nc1ccc(cc1F)F
STK774113
Synonyms: ethyl4-[(2-fluorophenyl)amino]-6-(3-methoxyphenyl)-2-oxocyclohex-3-ene-1-carboxylate
Smiles: CCOC(=O)C1C(=O)C=C(CC1c1cccc(c1)OC)Nc1ccccc1F
STK774114
Synonyms: N-[1-(furan-2-ylmethyl)-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]thiophene-2-carboxamide
Smiles: O=C(c1cccs1)NC1(NC(=O)N(C1=O)Cc1ccco1)C(F)(F)F
STK774115
Synonyms: 11,12-dihydroxy-4,8-bis(4-methoxyphenyl)-3,4,4a,5,6,7,7a,8-octahydrochromeno[3,2-i]quinazoline-2(1H)-thione
Smiles: COc1ccc(cc1)C1NC(=S)NC23C1CCCC3C(c1c(O2)c(O)c(O)cc1)c1ccc(cc1)OC
STK774116
Synonyms: 2,2,2-trifluoroethyl2-{[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]carbamoyl}cyclohexanecarboxylate
Smiles: O=C(C1CCCCC1C(=O)OCC(F)(F)F)NCCc1c(C)[nH]c2c1cc(F)cc2
STK774117
Synonyms: 2,2,2-trifluoroethyl2-[(2-{5-[chloro(difluoro)methoxy]-2-methyl-1H-indol-3-yl}ethyl)carbamoyl]cyclohexanecarboxylate
Smiles: O=C(C1CCCCC1C(=O)OCC(F)(F)F)NCCc1c(C)[nH]c2c1cc(cc2)OC(Cl)(F)F
STK774118
Synonyms: propan-2-yl6-[(2-{5-[chloro(difluoro)methoxy]-2-methyl-1H-indol-3-yl}ethyl)carbamoyl]cyclohex-3-ene-1-carboxylate
Smiles: CC(OC(=O)C1CC=CCC1C(=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(Cl)(F)F)C
STK774119
Synonyms: N-(6-cyano-1,3-benzodioxol-5-yl)-4-(4-nitrophenoxy)benzenesulfonamide
Smiles: N#Cc1cc2OCOc2cc1NS(=O)(=O)c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-]
STK774120
Synonyms: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-[methyl(phenylsulfonyl)amino]-3-phenylbutanamide
Smiles: O=C(CC(c1ccccc1)CN(S(=O)(=O)c1ccccc1)C)Nc1nnc(s1)Cc1ccccc1
STK774123
Synonyms: 1-(2-chloro-4-fluorophenyl)-3-pyridin-3-ylthiourea
Smiles: S=C(Nc1ccc(cc1Cl)F)Nc1cccnc1
STK774124
Synonyms: 1-(2-cyanoethyl)-1-phenyl-3-pyridin-3-ylthiourea
Smiles: N#CCCN(c1ccccc1)C(=S)Nc1cccnc1
STK774125
Synonyms: N,N'-bis(4-chlorophenyl)-1-methylhydrazine-1,2-dicarbothioamide
Smiles: Clc1ccc(cc1)NC(=S)NN(C(=S)Nc1ccc(cc1)Cl)C
STK774127
Synonyms: 2-(7-chloroquinolin-4-yl)-N-(3,5-dimethylphenyl)hydrazinecarbothioamide
Smiles: S=C(Nc1cc(C)cc(c1)C)NNc1ccnc2c1ccc(c2)Cl
STK774128
Synonyms: 1-(5-chloro-2-cyanophenyl)-3-[2-(morpholin-4-yl)ethyl]thiourea
Smiles: N#Cc1ccc(cc1NC(=S)NCCN1CCOCC1)Cl
STK774129
Synonyms: 1-ethyl-3-(2-methylphenyl)-1-(pyridin-4-ylmethyl)thiourea
Smiles: CCN(C(=S)Nc1ccccc1C)Cc1ccncc1
STK774130
Synonyms: 1-[4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-2-phenylethanone
Smiles: O=C(N1CCN(CC1)c1nc2c(o1)cccc2)Cc1ccccc1
STK774131
Synonyms: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl](cyclopropyl)methanone
Smiles: O=C(N1CCN(CC1)c1nc2c(o1)cccc2)C1CC1
STK774132
Synonyms: 2-[4-(ethylsulfonyl)piperazin-1-yl]-1,3-benzoxazole
Smiles: CCS(=O)(=O)N1CCN(CC1)c1nc2c(o1)cccc2
STK774133
Synonyms: 4-(1,3-benzoxazol-2-yl)-N,N-dimethylpiperazine-1-sulfonamide
Smiles: CN(S(=O)(=O)N1CCN(CC1)c1nc2c(o1)cccc2)C
STK774134
Synonyms: 2-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-1,3-benzoxazole
Smiles: O=S(=O)(c1ccc2c(c1)OCCO2)N1CCN(CC1)c1nc2c(o1)cccc2
STK774136
Synonyms: 1-(cyclopropylmethyl)-3-(4-ethoxyphenyl)-1-propylthiourea
Smiles: CCCN(C(=S)Nc1ccc(cc1)OCC)CC1CC1
STK774142
Synonyms: N-[2,5-dioxo-1-(pyridin-3-ylmethyl)-4-(trifluoromethyl)imidazolidin-4-yl]benzenesulfonamide
Smiles: O=C1NC(C(=O)N1Cc1cccnc1)(NS(=O)(=O)c1ccccc1)C(F)(F)F
STK774143
Synonyms: 2-chloro-N-[1-(4-fluorophenyl)-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]benzamide
Smiles: Fc1ccc(cc1)N1C2=C(C(C1=O)(NC(=O)c1ccccc1Cl)C(F)(F)F)C(=O)CC(C2)(C)C
STK774144
Synonyms: 2-chloro-N-[1-(3-chlorophenyl)-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]benzamide
Smiles: Clc1cccc(c1)N1C2=C(C(C1=O)(NC(=O)c1ccccc1Cl)C(F)(F)F)C(=O)CC(C2)(C)C
STK774145
Synonyms: N-[1-benzyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-2-fluorobenzamide
Smiles: Fc1ccccc1C(=O)NC1(C2=C(N(C1=O)Cc1ccccc1)CCCC2=O)C(F)(F)F
STK774146
Synonyms: 2-amino-4-(2,4-dimethoxyphenyl)-1-(dimethylamino)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(c(c1)OC)C1C(=C(N)N(C2=C1C(=O)CC(C2)c1ccccc1)N(C)C)C#N
STK774147
Synonyms: 2-amino-1-(dimethylamino)-4-[4-(dimethylamino)phenyl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc(cc1)N(C)C)C(=O)CC(C2)c1ccccc1
STK774148
Synonyms: N'-{[(4-fluorophenyl)carbonyl]oxy}-1,5-dimethyl-1H-pyrrole-2-carboximidamide
Smiles: Fc1ccc(cc1)C(=O)O/N=C(/c1ccc(n1C)C)\N
STK774149
Synonyms: N'-{[(4-methoxyphenyl)carbonyl]oxy}-1,5-dimethyl-1H-pyrrole-2-carboximidamide
Smiles: COc1ccc(cc1)C(=O)O/N=C(/c1ccc(n1C)C)\N
STK774150
Synonyms: 1-pyridin-3-yl-3-(2,3,4-trifluorophenyl)thiourea
Smiles: S=C(Nc1ccc(c(c1F)F)F)Nc1cccnc1
STK774151
Synonyms: 1-[2-(methylsulfanyl)phenyl]-3-pyridin-3-ylthiourea
Smiles: CSc1ccccc1NC(=S)Nc1cccnc1
STK774152
Synonyms: 1-ethyl-1-phenyl-3-pyridin-3-ylthiourea
Smiles: CCN(c1ccccc1)C(=S)Nc1cccnc1
STK774153
Synonyms: 3-(2-chlorophenyl)-1-(2-cyanoethyl)-1-(pyridin-3-ylmethyl)thiourea
Smiles: N#CCCN(C(=S)Nc1ccccc1Cl)Cc1cccnc1
STK774154
Synonyms: N-[2-(propan-2-yl)phenyl]-4-[2-({[2-(propan-2-yl)phenyl]carbamothioyl}amino)ethyl]piperazine-1-carbothioamide
Smiles: S=C(Nc1ccccc1C(C)C)NCCN1CCN(CC1)C(=S)Nc1ccccc1C(C)C
STK774155
Synonyms: 1-(2,4-dichlorophenyl)-3-[2-(3,4-dihydroxyphenyl)ethyl]thiourea
Smiles: S=C(Nc1ccc(cc1Cl)Cl)NCCc1ccc(c(c1)O)O
STK774156
Synonyms: 1,1'-propane-1,2-diylbis[3-(4-acetylphenyl)(thiourea)]
Smiles: S=C(Nc1ccc(cc1)C(=O)C)NCC(NC(=S)Nc1ccc(cc1)C(=O)C)C
STK774157
Synonyms: 1-{[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl}imidazolidin-2-one
Smiles: COc1ccc2c(c1)nc([nH]2)SCC(=O)N1CCNC1=O
STK774165
Synonyms: 3-(5-bromofuran-2-yl)-5-[(2-chlorophenoxy)methyl]-1,2,4-oxadiazole
Smiles: Brc1ccc(o1)c1noc(n1)COc1ccccc1Cl
STK774168
Synonyms: methyl4-[3-(5-bromofuran-2-yl)-1,2,4-oxadiazol-5-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)c1onc(n1)c1ccc(o1)Br
STK774171
Synonyms: N'-[(1,3-benzodioxol-5-ylcarbonyl)oxy]-1,5-dimethyl-1H-pyrrole-2-carboximidamide
Smiles: O=C(c1ccc2c(c1)OCO2)O/N=C(/c1ccc(n1C)C)\N
STK774172
Synonyms: 3-(5-bromofuran-2-yl)-5-(2-nitrophenyl)-1,2,4-oxadiazole
Smiles: Brc1ccc(o1)c1noc(n1)c1ccccc1[N+](=O)[O-]
STK774173
Synonyms: (5Z)-5-(furan-2-ylmethylidene)-2-phenyl-3,5-dihydro-4H-imidazol-4-one
Smiles: O=C1NC(=N/C/1=C\c1ccco1)c1ccccc1
STK774175
Synonyms: diethyl3,4-bis(2-hydroxyethoxy)thiophene-2,5-dicarboxylate
Smiles: OCCOc1c(sc(c1OCCO)C(=O)OCC)C(=O)OCC
STK774176
Synonyms: 3-amino-N-{4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl}-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)CCC1)Nc1ccc(cc1)S(=O)(=O)Nc1onc(c1C)C
STK774177
Synonyms: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-{[(4-bromophenyl)sulfonyl](methyl)amino}-3-phenylbutanamide
Smiles: O=C(CC(c1ccccc1)CN(S(=O)(=O)c1ccc(cc1)Br)C)Nc1nnc(s1)Cc1ccccc1
STK774178
Synonyms: 3-cyclohexyl-N-[6,6-dimethyl-2,4-dioxo-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]propanamide
Smiles: O=C(NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)Cc1cccnc1)C(F)(F)F)CCC1CCCCC1
STK774179
Synonyms: 2-amino-4-(2,3-dimethoxyphenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1OC)OC)oc(cc2=O)CO
STK774180
Synonyms: propan-2-yl2-amino-4-(2-chlorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: OCc1cc(=O)c2c(o1)C(C(=C(O2)N)C(=O)OC(C)C)c1ccccc1Cl
STK774181
Synonyms: 2-methoxyethyl2-amino-4-(2-chloro-6-fluorophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: COCCOC(=O)C1=C(N)Oc2c(C1c1c(F)cccc1Cl)oc(cc2=O)CO
STK774183
Synonyms: 2'-amino-1-ethyl-6'-(hydroxymethyl)-2,8'-dioxo-1,2-dihydro-8'H-spiro[indole-3,4'-pyrano[3,2-b]pyran]-3'-carbonitrile
Smiles: CCN1c2ccccc2C2(C1=O)C(=C(N)Oc1c2oc(CO)cc1=O)C#N
STK774184
Synonyms: 2'-amino-2,7',9'-trimethyl-4,5-dihydrospiro[furan-3,4'-pyrano[2',3':4,5]thieno[2,3-b]pyridine]-3'-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31CCOC3C)sc1c2c(C)cc(n1)C
STK774185
Synonyms: [4-amino-2-(methylamino)-1,3-thiazol-5-yl](tricyclo[3.3.1.1~3,7~]dec-1-yl)methanone
Smiles: CNc1sc(c(n1)N)C(=O)C12CC3CC(C2)CC(C1)C3
STK774186
Synonyms: methyl2-amino-4-(2-bromophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C1c1ccccc1Br)oc(cc2=O)CO
STK774188
Synonyms: N-(cyclopropylmethyl)-N-propylbenzene-1,4-disulfonamide
Smiles: CCCN(S(=O)(=O)c1ccc(cc1)S(=O)(=O)N)CC1CC1
STK774190
Synonyms: 4-{[(4-sulfamoylphenyl)sulfonyl]amino}benzamide
Smiles: NC(=O)c1ccc(cc1)NS(=O)(=O)c1ccc(cc1)S(=O)(=O)N
STK774193
Synonyms: 1-(3-chloro-2-methylphenyl)-3-(4H-1,2,4-triazol-4-yl)thiourea
Smiles: S=C(Nc1cccc(c1C)Cl)Nn1cnnc1
STK774194
Synonyms: ethyl2-[(2,4-dibromophenoxy)methyl]-5-methoxy-1-benzofuran-3-carboxylate
Smiles: CCOC(=O)c1c(COc2ccc(cc2Br)Br)oc2c1cc(OC)cc2
STK774195
Synonyms: 3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)SCc1nc2c([nH]1)cccc2
STK774196
Synonyms: 3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-1-(4-chlorophenyl)pyrrolidine-2,5-dione
Smiles: Clc1ccc(cc1)N1C(=O)CC(C1=O)SCc1nc2c([nH]1)cccc2
STK774197
Synonyms: 6-bromo-1-[(4-ethylphenyl)carbonyl]-1a-(furan-2-ylcarbonyl)-1-methyl-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one
Smiles: CCc1ccc(cc1)C(=O)C1(C)C2C1(C(=O)Oc1c2cc(Br)cc1)C(=O)c1ccco1
STK774198
Synonyms: 6-bromo-1-ethyl-1a-(furan-2-ylcarbonyl)-1-(phenylcarbonyl)-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one
Smiles: CCC1(C(=O)c2ccccc2)C2C1(C(=O)Oc1c2cc(Br)cc1)C(=O)c1ccco1
STK774200
Synonyms: 1a-(furan-2-ylcarbonyl)-1-methyl-1-(phenylcarbonyl)-1a,9c-dihydrobenzo[f]cyclopropa[c]chromen-2(1H)-one
Smiles: O=C1Oc2ccc3c(c2C2C1(C(=O)c1ccco1)C2(C)C(=O)c1ccccc1)cccc3
STK774201
Synonyms: 6-bromo-4-[1-(4-methylphenyl)-1-oxopropan-2-yl]-3-(phenylcarbonyl)-3,4-dihydro-2H-chromen-2-one
Smiles: Brc1ccc2c(c1)C(C(C(=O)c1ccc(cc1)C)C)C(C(=O)O2)C(=O)c1ccccc1
STK774202
Synonyms: 6-bromo-4-(1-oxo-1-phenylpropan-2-yl)-3-(phenylcarbonyl)-3,4-dihydro-2H-chromen-2-one
Smiles: Brc1ccc2c(c1)C(C(C(=O)c1ccccc1)C)C(C(=O)O2)C(=O)c1ccccc1
STK774203
Synonyms: N-benzyl-6-bromo-1-methyl-2-oxo-1-(phenylcarbonyl)-1,7b-dihydrocyclopropa[c]chromene-1a(2H)-carboxamide
Smiles: Brc1ccc2c(c1)C1C(C1(C(=O)O2)C(=O)NCc1ccccc1)(C)C(=O)c1ccccc1
STK774204
Synonyms: 1-methyl-1a-(morpholin-4-ylcarbonyl)-1-(phenylcarbonyl)-1a,9c-dihydrobenzo[f]cyclopropa[c]chromen-2(1H)-one
Smiles: O=C(C1(C)C2C1(C(=O)Oc1c2c2ccccc2cc1)C(=O)N1CCOCC1)c1ccccc1
STK774205
Synonyms: 6-bromo-1-ethyl-1a-(morpholin-4-ylcarbonyl)-1-(phenylcarbonyl)-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one
Smiles: CCC1(C(=O)c2ccccc2)C2C1(C(=O)Oc1c2cc(Br)cc1)C(=O)N1CCOCC1
STK774207
Synonyms: 6-bromo-1-[(4-ethylphenyl)carbonyl]-1-methyl-1a-(piperidin-1-ylcarbonyl)-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one
Smiles: CCc1ccc(cc1)C(=O)C1(C)C2C1(C(=O)Oc1c2cc(Br)cc1)C(=O)N1CCCCC1
STK774208
Synonyms: 3-(4-bromophenyl)-2-(phenylamino)-2-azaspiro[3.5]nonan-1-one
Smiles: Brc1ccc(cc1)C1N(Nc2ccccc2)C(=O)C21CCCCC2
STK774209
Synonyms: 2-[(3-iodobenzyl)oxy]benzaldehyde
Smiles: O=Cc1ccccc1OCc1cccc(c1)I
STK774210
Synonyms: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Smiles: NNC(=O)c1nnn(c1c1cccs1)c1nonc1N
STK774211
Synonyms: N-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]carbamoyl}-3-(1,1,2,2-tetrafluoroethoxy)benzamide
Smiles: O=C(NC(=O)c1cccc(c1)OC(C(F)F)(F)F)Nc1nc(C)cc(n1)C(F)(F)F
STK774215
Synonyms: 2-{[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}-1-(thiophen-2-yl)ethanone
Smiles: CCNc1nc(NCC)nc2n1c(SCC(=O)c1cccs1)nn2
STK774217
Synonyms: 2-{4-[(4-tert-butylphenyl)sulfonyl]piperazin-1-yl}-1,3-benzoxazole
Smiles: O=S(=O)(c1ccc(cc1)C(C)(C)C)N1CCN(CC1)c1nc2c(o1)cccc2
STK774218
Synonyms: 2-(4-chlorophenyl)-6,7-dimethoxy-3,3a-dihydro-8H-pyrazolo[5,1-a]isoindol-8-one
Smiles: COc1c(OC)ccc2c1C(=O)N1C2CC(=N1)c1ccc(cc1)Cl
STK774219
Synonyms: 2-(4-fluorophenyl)-6,7-dimethoxy-2,3-dihydro-1H-isoindol-1-one
Smiles: COc1ccc2c(c1OC)C(=O)N(C2)c1ccc(cc1)F
STK774220
Synonyms: methyl(2E)-2-(furan-3-ylmethylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C\c1cocc1)/s2
STK774221
Synonyms: ethyl(2Z)-2-[(4-chloroquinolin-2-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1cc(Cl)c3c(n1)cccc3)/s2
STK774222
Synonyms: (2E)-2-(4-methoxybenzylidene)-7-methyl-N-(2-methylphenyl)-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Smiles: COc1ccc(cc1)/C=c\1/sc2=NC(=C(C(n2c1=O)c1cccs1)C(=O)Nc1ccccc1C)C
STK774223
Synonyms: 10-(1,3-benzodioxol-5-yl)-7,7-dimethyl-6,7,8,10-tetrahydro[1,3]dioxolo[4,5-b]acridin-9(5H)-one
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccc3c(c1)OCO3)c1c(N2)cc2c(c1)OCO2
STK774224
Synonyms: N-(3-acetylphenyl)-2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}acetamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)COc1nsnc1N1CCOCC1
STK774226
Synonyms: (1S,2S,5R)-2-[4-(3,5-dimethylphenyl)-5-thioxo-4,5-dihydro-1H-tetrazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: Cc1cc(C)cc(c1)n1nnn(c1=S)[C@H]1CC(=O)[C@H]2O[C@@H]1CO2
STK774227
Synonyms: ethyl4-[({[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}acetyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)COc1nsnc1N1CCOCC1
STK774228
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-{[5-(propan-2-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetamide
Smiles: COc1cc(CCNC(=O)CSc2nnc3c(n2)n(C(C)C)c2c3cccc2)ccc1OC
STK774229
Synonyms: (5E)-1-methyl-5-({5-[4-(trifluoromethoxy)phenyl]furan-2-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CN1C(=O)NC(=O)/C(=C\c2ccc(o2)c2ccc(cc2)OC(F)(F)F)/C1=O
STK774230
Synonyms: (1R,2R,5S)-2-{4-[2-(methylsulfanyl)phenyl]-5-thioxo-4,5-dihydro-1H-tetrazol-1-yl}-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: CSc1ccccc1n1nnn(c1=S)[C@@H]1CC(=O)[C@@H]2O[C@H]1CO2
STK774231
Synonyms: 2-[(3,4-dichlorobenzyl)sulfonyl]-3H-imidazo[4,5-b]pyridine
Smiles: Clc1ccc(cc1Cl)CS(=O)(=O)c1nc2c([nH]1)nccc2
STK774232
Synonyms: (2E)-2-[(1R,2R,5S)-2-(1H-benzotriazol-1-yl)-6,8-dioxabicyclo[3.2.1]oct-4-ylidene]hydrazinecarbothioamide(non-preferredname)
Smiles: NC(=S)N/N=C/1\C[C@H]([C@H]2O[C@@H]1OC2)n1nnc2c1cccc2
STK774234
Synonyms: 4-hydroxy-3,4,5-trimethyl-5-(2-phenylethyl)-1,3-oxazolidin-2-one
Smiles: O=C1OC(C(N1C)(C)O)(C)CCc1ccccc1
STK774236
Synonyms: 4-hydroxy-3-(2-hydroxyethyl)-4,5-dimethyl-5-(2-phenylethyl)-1,3-oxazolidin-2-one
Smiles: OCCN1C(=O)OC(C1(C)O)(C)CCc1ccccc1
STK774237
Synonyms: 4-hydroxy-4,5-dimethyl-5-(2-phenylethyl)-3-(pyridin-2-ylmethyl)-1,3-oxazolidin-2-one
Smiles: O=C1OC(C(N1Cc1ccccn1)(C)O)(C)CCc1ccccc1
STK774239
Synonyms: 1-(2-methoxyethyl)-2-{1-[4-(2-methylpropyl)phenyl]ethyl}-1H-benzimidazole
Smiles: COCCn1c(nc2c1cccc2)C(c1ccc(cc1)CC(C)C)C
STK774242
Synonyms: 10-(diethylamino)-N,N-diethyl-10,11-dihydro-5H-dibenzo[b,f]azepine-5-carboxamide
Smiles: CCN(C(=O)N1c2ccccc2C(Cc2c1cccc2)N(CC)CC)CC
STK774245
Synonyms: (2,4-difluorophenyl)[4-(4-fluoro-2-nitrophenyl)piperazin-1-yl]methanone
Smiles: Fc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccc(cc1F)F
STK774246
Synonyms: 4-(2-hydroxynaphthalen-1-yl)-1-(4-methoxyphenyl)-3,3-dimethylazetidin-2-one
Smiles: COc1ccc(cc1)N1C(=O)C(C1c1c(O)ccc2c1cccc2)(C)C
STK774248
Synonyms: N-[4-(trifluoromethoxy)phenyl]-2-[5-(3,4,5-trimethoxyphenyl)-2H-tetrazol-2-yl]acetamide
Smiles: COc1cc(cc(c1OC)OC)c1nnn(n1)CC(=O)Nc1ccc(cc1)OC(F)(F)F
STK774249
Synonyms: (3Z)-3-(furan-2-ylmethylidene)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1C/C(=C\c2ccco2)/c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]
STK774252
Synonyms: (3Z)-3-(4-fluorobenzylidene)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1C/C(=C\c2ccc(cc2)F)/c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]
STK774253
Synonyms: 4-[3-(5-bromofuran-2-yl)-1,2,4-oxadiazol-5-yl]pyridine
Smiles: Brc1ccc(o1)c1noc(n1)c1ccncc1
STK774254
Synonyms: ethyl3-{[(4-chlorophenyl)sulfonyl]amino}-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NS(=O)(=O)c1ccc(cc1)Cl
STK774255
Synonyms: ethyl3-({[4-(acetylamino)phenyl]sulfonyl}amino)-3-(4-methylphenyl)propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)C)NS(=O)(=O)c1ccc(cc1)NC(=O)C
STK774256
Synonyms: 4,7-dichloro-6-(trichloromethyl)[1,3]dithiolo[4,5-c]pyridin-2-one
Smiles: O=c1sc2c(s1)c(Cl)nc(c2Cl)C(Cl)(Cl)Cl
STK774258
Synonyms: 5-(4-chlorophenyl)-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Cl)CCc1c(C)[nH]c2c1cccc2
STK774259
Synonyms: N-(6-cyano-1,3-benzodioxol-5-yl)-2-[5-(2-fluorophenyl)-2H-tetrazol-2-yl]acetamide
Smiles: N#Cc1cc2OCOc2cc1NC(=O)Cn1nnc(n1)c1ccccc1F
STK774260
Synonyms: 3-(trifluoromethyl)benzyl3-{2-[3-(trifluoromethyl)benzyl]-2H-tetrazol-5-yl}benzoate
Smiles: O=C(c1cccc(c1)c1nnn(n1)Cc1cccc(c1)C(F)(F)F)OCc1cccc(c1)C(F)(F)F
STK774261
Synonyms: (2Z)-2-{(1R,2R,5S)-2-[4-(3,5-dimethylphenyl)-5-thioxo-4,5-dihydro-1H-tetrazol-1-yl]-6,8-dioxabicyclo[3.2.1]oct-4-ylidene}hydrazinecarbothioamide(non-preferredname)
Smiles: NC(=S)N/N=C\1/C[C@H]([C@H]2O[C@@H]1OC2)n1nnn(c1=S)c1cc(C)cc(c1)C
STK774263
Synonyms: 1-(4-cyanophenyl)-3-[2-(morpholin-4-yl)ethyl]thiourea
Smiles: N#Cc1ccc(cc1)NC(=S)NCCN1CCOCC1
STK774264
Synonyms: 1-cyclohexyl-1-ethyl-3-(2-fluorophenyl)thiourea
Smiles: CCN(C(=S)Nc1ccccc1F)C1CCCCC1
STK774266
Synonyms: 3-(4-acetylphenyl)-1-(3-{[(4-acetylphenyl)carbamothioyl]amino}propyl)-1-cyclohexylthiourea(non-preferredname)
Smiles: S=C(Nc1ccc(cc1)C(=O)C)NCCCN(C(=S)Nc1ccc(cc1)C(=O)C)C1CCCCC1
STK774267
Synonyms: 1-[2-(butan-2-yl)phenyl]-3-pyridin-3-ylthiourea
Smiles: CCC(c1ccccc1NC(=S)Nc1cccnc1)C
STK774268
Synonyms: 3-(4-acetylphenyl)-1-cyclohexyl-1-ethylthiourea
Smiles: CCN(C(=S)Nc1ccc(cc1)C(=O)C)C1CCCCC1
STK774269
Synonyms: 2-amino-1-(dimethylamino)-4-(2,5-dimethylthiophen-3-yl)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cc(sc1C)C)C(=O)CC(C2)c1ccccc1
STK774270
Synonyms: 3-[(2-fluorophenyl)amino]-5-(4-methoxyphenyl)cyclohex-2-en-1-one
Smiles: COc1ccc(cc1)C1CC(=CC(=O)C1)Nc1ccccc1F
STK774272
Synonyms: 3-[(4-fluorophenyl)amino]-5-(4-methoxyphenyl)cyclohex-2-en-1-one
Smiles: COc1ccc(cc1)C1CC(=CC(=O)C1)Nc1ccc(cc1)F
STK774273
Synonyms: 2-{[5-(4-methoxyphenyl)-3-oxocyclohex-1-en-1-yl]amino}benzonitrile
Smiles: COc1ccc(cc1)C1CC(=CC(=O)C1)Nc1ccccc1C#N
STK774275
Synonyms: 4-(4-fluorophenyl)-7,7-dimethyl-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CCCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)F
STK774276
Synonyms: 4-(4-fluorophenyl)-7,7-dimethyl-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)F
STK774277
Synonyms: 4-(2-fluorophenyl)-7,7-dimethyl-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccccc1F
STK774278
Synonyms: 4-(2,4-dichlorophenyl)-7,7-dimethyl-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CCCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1Cl)Cl
STK774279
Synonyms: N,N-diethyl-2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carboxamide
Smiles: CCN(C(=O)c1scc2c1OCCO2)CC
STK774281
Synonyms: 1-[(2,5-dimethylthiophen-3-yl)sulfonyl]-4-(2-methoxyphenyl)piperazine
Smiles: COc1ccccc1N1CCN(CC1)S(=O)(=O)c1cc(sc1C)C
STK774283
Synonyms: 5-(1,3-benzodioxol-5-yl)-3-ethyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: CCn1c(=S)sc2c1nc([nH]c2=O)c1ccc2c(c1)OCO2
STK774287
Synonyms: 7-(diethylamino)-3-phenyl-5-propyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCc1nc(N(CC)CC)c2c(n1)n(c1ccccc1)c(=S)s2
STK774288
Synonyms: 7-(dipropylamino)-3-phenyl-5-propyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCc1nc(N(CCC)CCC)c2c(n1)n(c1ccccc1)c(=S)s2
STK774289
Synonyms: 3-phenyl-7-(piperidin-1-yl)-5-propyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCc1nc(N2CCCCC2)c2c(n1)n(c1ccccc1)c(=S)s2
STK774290
Synonyms: 7-(azepan-1-yl)-3-phenyl-5-propyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCc1nc(N2CCCCCC2)c2c(n1)n(c1ccccc1)c(=S)s2
STK774291
Synonyms: 7-(2,3-dihydro-1H-indol-1-yl)-3-phenyl-5-propyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCc1nc(N2CCc3c2cccc3)c2c(n1)n(c1ccccc1)c(=S)s2
STK774292
Synonyms: 7-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-phenyl-5-propyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCc1nc(Sc2nncn2C)c2c(n1)n(c1ccccc1)c(=S)s2
STK774293
Synonyms: 2'-ethyl-1,3-dimethyl-6'-nitro-1'-propyl-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-2,4,6(1H,3H)-trione
Smiles: CCCN1c2ccc(cc2CC2(C1CC)C(=O)N(C)C(=O)N(C2=O)C)[N+](=O)[O-]
STK774294
Synonyms: 7-(dipropylamino)-3,5-dimethyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCN(c1nc(C)nc2c1sc(=S)n2C)CCC
STK774295
Synonyms: 3,5-dimethyl-7-(piperidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: Cc1nc(N2CCCCC2)c2c(n1)n(C)c(=S)s2
STK774296
Synonyms: 1-benzyl-3'-methyl-5'-phenyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC1NC2(C3C1C(=O)N(C3=O)c1ccccc1)C(=O)N(c1c2cccc1)Cc1ccccc1
STK774297
Synonyms: 1,5'-dibenzyl-3'-ethyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCC1NC2(C3C1C(=O)N(C3=O)Cc1ccccc1)C(=O)N(c1c2cccc1)Cc1ccccc1
STK774298
Synonyms: 1-benzyl-3'-[2-(methylsulfanyl)ethyl]-5'-phenyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CSCCC1NC2(C3C1C(=O)N(C3=O)c1ccccc1)C(=O)N(c1c2cccc1)Cc1ccccc1
STK774299
Synonyms: 1,5'-dibenzyl-3'-methyl-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC1NC2(C3C1C(=O)N(C3=O)Cc1ccccc1)C(=O)N(c1c2cccc1)Cc1ccccc1
STK774300
Synonyms: 1-benzyl-3'-ethyl-5'-(naphthalen-1-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCC1NC2(C3C1C(=O)N(C3=O)c1cccc3c1cccc3)C(=O)N(c1c2cccc1)Cc1ccccc1
STK774302
Synonyms: N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CN1C(=O)OC(C1(C)O)(C)C
STK774303
Synonyms: 3,4,4-trichloro-1-(3,5-dimethyl-1H-pyrazol-1-yl)but-3-en-1-one
Smiles: O=C(n1nc(cc1C)C)CC(=C(Cl)Cl)Cl
STK774304
Synonyms: 4-formyl-2-methoxyphenyl4,5-dichloro-1,2-thiazole-3-carboxylate
Smiles: COc1cc(C=O)ccc1OC(=O)c1nsc(c1Cl)Cl
STK774305
Synonyms: 3-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-5-ethyl-4-hydroxy-4,5-dimethyl-1,3-oxazolidin-2-one
Smiles: CCC1(C)OC(=O)N(C1(C)O)CCc1c(C)[nH]c2c1cccc2Cl
STK774306
Synonyms: 2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(4-methylphenyl)acetamide
Smiles: O=C(CN1C(=O)OC(C1(C)O)(C)C)Nc1ccc(cc1)C
STK774307
Synonyms: 4-hydroxy-4,5-dimethyl-3-[2-(2-methyl-1H-indol-3-yl)ethyl]-5-(4-methylpent-3-en-1-yl)-1,3-oxazolidin-2-one
Smiles: CC(=CCCC1(C)OC(=O)N(C1(C)O)CCc1c(C)[nH]c2c1cccc2)C
STK774308
Synonyms: 3-[2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]-5-ethyl-4-hydroxy-4,5-dimethyl-1,3-oxazolidin-2-one
Smiles: CCC1(C)OC(=O)N(C1(C)O)CCc1c(C)[nH]c2c1cc(Br)cc2
STK774309
Synonyms: 3-[2-(7-chloro-2-methyl-1H-indol-3-yl)ethyl]-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(N1CCc1c(C)[nH]c3c1cccc3Cl)(C)O)CCCCC2
STK774310
Synonyms: 3-benzyl-7-(morpholin-4-yl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Smiles: O1CCN(CC1)c1ncnc2c1nnn2Cc1ccccc1
STK774312
Synonyms: 3-benzyl-7-(2,3-dihydro-1H-indol-1-yl)-3H-[1,2,3]triazolo[4,5-d]pyrimidine
Smiles: c1ccc(cc1)Cn1nnc2c1ncnc2N1CCc2c1cccc2
STK774313
Synonyms: 5'-butyl-3'-(2-methylpropyl)-1-(prop-2-en-1-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CCCCN1C(=O)C2C(C1=O)C1(NC2CC(C)C)C(=O)N(c2c1cccc2)CC=C
STK774314
Synonyms: 5-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-3-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: C=CCOc1ccc(cc1OC)c1[nH]c(=O)c2c(n1)n(C)c(=S)s2
STK774315
Synonyms: 5-(3,4-diethoxyphenyl)-3-methyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: CCOc1cc(ccc1OCC)c1[nH]c(=O)c2c(n1)n(C)c(=S)s2
STK774316
Synonyms: 3-benzyl-5-{3-[(2-methylprop-2-en-1-yl)oxy]phenyl}-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: CC(=C)COc1cccc(c1)c1[nH]c(=O)c2c(n1)n(Cc1ccccc1)c(=S)s2
STK774317
Synonyms: 5-{3-[(2-methylprop-2-en-1-yl)oxy]phenyl}-3-(prop-2-en-1-yl)-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: C=CCn1c(=S)sc2c1nc([nH]c2=O)c1cccc(c1)OCC(=C)C
STK774318
Synonyms: 5-(5-bromothiophen-2-yl)-3-phenyl-2-thioxo-2,3-dihydro[1,3]thiazolo[4,5-d]pyrimidin-7(6H)-one
Smiles: Brc1ccc(s1)c1[nH]c(=O)c2c(n1)n(c1ccccc1)c(=S)s2
STK774319
Synonyms: 7-(dimethylamino)-3-phenyl-5-propyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCc1nc(N(C)C)c2c(n1)n(c1ccccc1)c(=S)s2
STK774320
Synonyms: 3-phenyl-5-propyl-7-(pyrrolidin-1-yl)[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCc1nc(N2CCCC2)c2c(n1)n(c1ccccc1)c(=S)s2
STK774322
Synonyms: 1-benzyl-3'-methyl-5'-(naphthalen-1-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Smiles: CC1NC2(C3C1C(=O)N(C3=O)c1cccc3c1cccc3)C(=O)N(c1c2cccc1)Cc1ccccc1
STK774323
Synonyms: 4-fluorophenyl4,5-dichloro-1,2-thiazole-3-carboxylate
Smiles: Fc1ccc(cc1)OC(=O)c1nsc(c1Cl)Cl
STK774324
Synonyms: 11-ethyl-3,5,11,11a-tetramethyl-6,7,11,11a-tetrahydro-4H-[1,3]oxazolo[3',4':1,2]azepino[5,4,3-cd]indol-9-one
Smiles: CCC1(C)OC(=O)N2C1(C)c1ccc(c3c1c(CC2)c([nH]3)C)C
STK774325
Synonyms: 3',5',11a'-trimethyl-4',6',7',11a'-tetrahydrospiro[cyclohexane-1,11'-[1,3]oxazolo[3',4':1,2]azepino[5,4,3-cd]indol]-9'-one
Smiles: O=C1OC2(C3(N1CCc1c4c3ccc(c4[nH]c1C)C)C)CCCCC2
STK774328
Synonyms: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl](3-fluorophenyl)methanone
Smiles: Fc1cccc(c1)C(=O)N1CCN(CC1)c1nc2c(o1)cccc2
STK774330
Synonyms: N-(4-bromophenyl)-2-({1-[4-(trifluoromethoxy)phenyl]-1H-tetrazol-5-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Br)CSc1nnnn1c1ccc(cc1)OC(F)(F)F
STK774331
Synonyms: 1-[(1H-benzimidazol-2-ylsulfanyl)acetyl]imidazolidin-2-one
Smiles: O=C(N1CCNC1=O)CSc1nc2c([nH]1)cccc2
STK774332
Synonyms: 8-(4-butanoylphenoxy)-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCC(=O)c1ccc(cc1)Oc1nc2c(n1CCC(C)C)c(=O)n(c(=O)n2C)C
STK774333
Synonyms: N-[4-(acetylamino)-1,2,5-oxadiazol-3-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)Nc1nonc1NC(=O)C
STK774334
Synonyms: N-(2,3-dichlorophenyl)-2-({1-[4-(trifluoromethoxy)phenyl]-1H-tetrazol-5-yl}sulfanyl)acetamide
Smiles: O=C(Nc1cccc(c1Cl)Cl)CSc1nnnn1c1ccc(cc1)OC(F)(F)F
STK774335
Synonyms: (5E)-1-phenyl-5-({5-[4-(trifluoromethoxy)phenyl]furan-2-yl}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1ccc(o1)c1ccc(cc1)OC(F)(F)F)c1ccccc1
STK774338
Synonyms: 1,3a,9b-trimethyl-3a,4,5,9b-tetrahydronaphtho[1,2-d][1,3]oxazol-2(1H)-one
Smiles: O=C1OC2(C(N1C)(C)c1ccccc1CC2)C
STK774339
Synonyms: 3-(8-methyl-1,2-dihydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)propanamide
Smiles: NC(=O)CCN1CCn2c3c1cccc3c1c2ccc(c1)C
STK774341
Synonyms: 3-nitro-5,7-diphenylpyrazolo[1,5-a]pyrimidin-2-amine
Smiles: [O-][N+](=O)c1c(N)nn2c1nc(cc2c1ccccc1)c1ccccc1
STK774343
Synonyms: 4,4'-piperazine-1,4-diylbis(6-chloro-2-methyl-5-nitropyrimidine)
Smiles: Cc1nc(N2CCN(CC2)c2nc(C)nc(c2[N+](=O)[O-])Cl)c(c(n1)Cl)[N+](=O)[O-]
STK774344
Synonyms: (3Z)-3-(4-chlorobenzylidene)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1C/C(=C\c2ccc(cc2)Cl)/c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]
STK774345
Synonyms: (3Z)-3-[(5-methylfuran-2-yl)methylidene]-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1C/C(=C\c2ccc(o2)C)/c2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]
STK774346
Synonyms: N-[4-(cyanomethyl)phenyl]-2-methoxyacetamide
Smiles: COCC(=O)Nc1ccc(cc1)CC#N
STK774347
Synonyms: 2-({[(E)-amino(4-amino-1,2,5-oxadiazol-3-yl)methylidene]amino}oxy)-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CO/N=C(\c1nonc1N)/N
STK774348
Synonyms: N-(2-iodophenyl)-2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}acetamide
Smiles: O=C(Nc1ccccc1I)COc1nsnc1N1CCOCC1
STK774349
Synonyms: 2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CSc1[nH]c2c(n1)cc(c(c2)C)C
STK774350
Synonyms: 1,1'-(2,5-dichlorobenzene-1,4-diyl)bis[3-(2-methoxyphenyl)(thiourea)]
Smiles: COc1ccccc1NC(=S)Nc1cc(Cl)c(cc1Cl)NC(=S)Nc1ccccc1OC
STK774351
Synonyms: ethyl2-{[5-(4-methoxyphenyl)-3-oxocyclohex-1-en-1-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC2=CC(=O)CC(C2)c2ccc(cc2)OC)sc2c1CCCC2
STK774352
Synonyms: 1-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(4-fluorophenyl)-7,7-dimethyl-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)F
STK774353
Synonyms: 4-(4-chlorophenyl)-7,7-dimethyl-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CCCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)Cl
STK774354
Synonyms: 4-(4-chlorophenyl)-7,7-dimethyl-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)Cl
STK774355
Synonyms: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-7,7-dimethyl-4-phenyl-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(C)(C)CC2=C1C(CC(=O)N2c1nnc(s1)SCc1ccccc1)c1ccccc1
STK774357
Synonyms: 2-amino-1-(dimethylamino)-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1cc(sc1C)C)C(=O)CC(C2)(C)C
STK774364
Synonyms: 12H-[1,3]benzothiazolo[2,3-b]quinazolin-12-one
Smiles: O=c1c2ccccc2nc2n1c1ccccc1s2
STK774365
Synonyms: 7-(3,4-dimethoxyphenyl)-8-(2-hydroxy-2-phenylethyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(ccc1OC)c1cn2c(n1CC(c1ccccc1)O)nc1c2c(=O)n(C)c(=O)n1C
STK774366
Synonyms: 7-(3,4-dimethoxyphenyl)-8-(4-fluorophenyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(ccc1OC)c1cn2c(n1c1ccc(cc1)F)nc1c2c(=O)n(C)c(=O)n1C
STK774367
Synonyms: 7-(3,4-dimethoxyphenyl)-1,3-dimethyl-8-(2-methylphenyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Smiles: COc1cc(ccc1OC)c1cn2c(n1c1ccccc1C)nc1c2c(=O)n(C)c(=O)n1C
STK774368
Synonyms: 7-(3,4-dimethoxyphenyl)-1,3-dimethyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: COc1cc(ccc1OC)c1cn2c(o1)nc1c2c(=O)n(C)c(=O)n1C
STK774369
Synonyms: 6-(furan-2-ylmethyl)-1-methyl-4-phenyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: O=C1NC(c2ccccc2)C2=C(N1C)CN(C2=O)Cc1ccco1
STK774370
Synonyms: 1,3-dimethyl-8-(4-methylpiperidin-1-yl)-7-[2-(3-nitrophenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC1CCN(CC1)c1nc2c(n1CC(=O)c1cccc(c1)[N+](=O)[O-])c(=O)n(c(=O)n2C)C
STK774371
Synonyms: 6-(2-hydroxyethyl)-4-(4-hydroxyphenyl)-1-methyl-3,4,6,7-tetrahydro-1H-pyrrolo[3,4-d]pyrimidine-2,5-dione
Smiles: OCCN1CC2=C(C1=O)C(NC(=O)N2C)c1ccc(cc1)O
STK774372
Synonyms: ethyl4-{[(5-methyl-2,1,3-benzothiadiazol-4-yl)sulfonyl]amino}butanoate
Smiles: CCOC(=O)CCCNS(=O)(=O)c1c(C)ccc2c1nsn2
STK774373
Synonyms: ethyl4-methyl-2-[(1,1,1-trifluoro-2-{[(4-fluorophenyl)carbonyl]amino}-3-methoxy-3-oxopropan-2-yl)amino]-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccc(cc1)F
STK774376
Synonyms: methyl2-azido-2-deoxy-4,6-O-(1-phenylethylidene)hexopyranoside
Smiles: COC1OC2COC(OC2C(C1N=[N+]=[N-])O)(C)c1ccccc1
STK774377
Synonyms: 2-imino-3-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1,3-thiazolidin-4-one
Smiles: N=C1SCC(=O)N1c1nonc1n1cccc1
STK774378
Synonyms: 2-{[1-(2-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CSc1nnnn1c1ccccc1F
STK774379
Synonyms: 2-{[1-(3,5-dimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CSc1nnnn1c1cc(C)cc(c1)C
STK774383
Synonyms: (1S,2S,5R)-2-[4-(3-acetylphenyl)-5-thioxo-4,5-dihydro-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)n1nnn(c1=S)c1cccc(c1)C(=O)C
STK774384
Synonyms: 2-[1-benzyl-3-(methylsulfanyl)-1H-indol-2-yl]-N-(2,4-dichlorophenyl)acetamide
Smiles: CSc1c(CC(=O)Nc2ccc(cc2Cl)Cl)n(c2c1cccc2)Cc1ccccc1
STK774385
Synonyms: dibenzyl4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Smiles: COc1cc(ccc1O)C1C(C(=O)OCc2ccccc2)C(=O)CC(C1C(=O)OCc1ccccc1)(C)O
STK774386
Synonyms: 2-(2-chlorophenyl)-3-nitro-2H-chromene
Smiles: [O-][N+](=O)C1=Cc2ccccc2OC1c1ccccc1Cl
STK774387
Synonyms: 3-(5-bromofuran-2-yl)-5-(3,4-diethoxybenzyl)-1,2,4-oxadiazole
Smiles: CCOc1cc(ccc1OCC)Cc1onc(n1)c1ccc(o1)Br
STK774388
Synonyms: 3-(5-bromofuran-2-yl)-5-[(2,4-difluorophenoxy)methyl]-1,2,4-oxadiazole
Smiles: Fc1ccc(c(c1)F)OCc1onc(n1)c1ccc(o1)Br
STK774389
Synonyms: 3-(5-bromofuran-2-yl)-5-[2-(4-methoxyphenyl)ethyl]-1,2,4-oxadiazole
Smiles: COc1ccc(cc1)CCc1onc(n1)c1ccc(o1)Br
STK774390
Synonyms: 3-(5-bromofuran-2-yl)-5-(2-ethoxyphenyl)-1,2,4-oxadiazole
Smiles: CCOc1ccccc1c1onc(n1)c1ccc(o1)Br
STK774393
Synonyms: 3-(5-bromofuran-2-yl)-5-[(naphthalen-2-yloxy)methyl]-1,2,4-oxadiazole
Smiles: Brc1ccc(o1)c1noc(n1)COc1ccc2c(c1)cccc2
STK774394
Synonyms: 5-(4-nitrophenyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
Smiles: [O-][N+](=O)c1ccc(cc1)c1onc(n1)c1cccs1
STK774402
Synonyms: 1-(methoxymethyl)-3-methyl-12b,13-dihydropyrido[3'',2'':4',5']thieno[3',2':4,5]pyrimido[2,1-a]isoindole-6,8-dione
Smiles: COCc1cc(C)nc2c1c1NC3c4ccccc4C(=O)N3C(=O)c1s2
STK774403
Synonyms: 4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbohydrazide
Smiles: NNC(=O)c1sc2c(c1n1cccc1)c(C)cc(n2)C
STK774404
Synonyms: 5-chloro-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbohydrazide
Smiles: NNC(=O)c1sc2c(c1n1cccc1)c(C)c(c(n2)C)Cl
STK774405
Synonyms: ethyl6-(bromomethyl)-4-(4-hydroxyphenyl)-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(CBr)N(C(=O)NC1c1ccc(cc1)O)C
STK774406
Synonyms: 3-imino-1-(morpholin-4-yl)-5,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]indole-2-carbonitrile
Smiles: N#CC1=C(N2CCOCC2)c2n(C1=N)c1CCCCc1c2
STK774408
Synonyms: 1-(ethylsulfanyl)-3-imino-5,6,7,8-tetrahydro-3H-pyrrolo[1,2-a]indole-2-carbonitrile
Smiles: CCSC1=C(C#N)C(=N)n2c1cc1c2CCCC1
STK774410
Synonyms: 4-[4-fluoro-5-(4-methylpiperidin-1-yl)-2-nitrophenyl]morpholine
Smiles: CC1CCN(CC1)c1cc(N2CCOCC2)c(cc1F)[N+](=O)[O-]
STK774411
Synonyms: 1-[2-fluoro-4-nitro-5-(piperidin-1-yl)phenyl]-4-methylpiperidine
Smiles: CC1CCN(CC1)c1cc(N2CCCCC2)c(cc1F)[N+](=O)[O-]
STK774412
Synonyms: {4-[5-(azepan-1-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(2,3-difluorophenyl)methanone
Smiles: [O-][N+](=O)c1cc(F)c(cc1N1CCN(CC1)C(=O)c1cccc(c1F)F)N1CCCCCC1
STK774413
Synonyms: 5-(2-fluorophenyl)-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1F)CCc1c(C)[nH]c2c1cccc2
STK774415
Synonyms: (3beta,8xi,9xi,14xi,17xi)-3-hydroxy-20,24-epoxychol-5-en-24-one
Smiles: O[C@H]1CC[C@]2(C(=CCC3C2CC[C@]2(C3CCC2[C@@]2(C)CCC(=O)O2)C)C1)C
STK774417
Synonyms: (16E)-3-hydroxy-16-[4-(trifluoromethyl)benzylidene]androst-5-en-17-one
Smiles: OC1CCC2(C(=CCC3C2CCC2(C3C/C(=C\c3ccc(cc3)C(F)(F)F)/C2=O)C)C1)C
STK774421
Synonyms: 3-(5-bromofuran-2-yl)-5-[(2,4-dichlorophenoxy)methyl]-1,2,4-oxadiazole
Smiles: Clc1ccc(c(c1)Cl)OCc1onc(n1)c1ccc(o1)Br
STK774422
Synonyms: 3-(5-bromofuran-2-yl)-5-(2-methyl-3-nitrophenyl)-1,2,4-oxadiazole
Smiles: Brc1ccc(o1)c1noc(n1)c1cccc(c1C)[N+](=O)[O-]
STK774424
Synonyms: 3-(5-bromofuran-2-yl)-5-[(2-methylphenoxy)methyl]-1,2,4-oxadiazole
Smiles: Brc1ccc(o1)c1noc(n1)COc1ccccc1C
STK774426
Synonyms: 3-(5-bromofuran-2-yl)-5-(2-methoxybenzyl)-1,2,4-oxadiazole
Smiles: COc1ccccc1Cc1onc(n1)c1ccc(o1)Br
STK774428
Synonyms: 3-[4-(4-methylpiperidin-1-yl)-6-{[2-(morpholin-4-yl)ethyl]amino}-1,3,5-triazin-2-yl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: CC1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CC2CC(C1)c1n(C2)c(=O)ccc1
STK774429
Synonyms: N-[1-cyclohexyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]thiophene-2-carboxamide
Smiles: O=C1NC(C(=O)N1C1CCCCC1)(NC(=O)c1cccs1)C(F)(F)F
STK774430
Synonyms: N-[4-acetyl-1-benzyl-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl]furan-2-carboxamide
Smiles: CC(=O)C1=C(C)N(C(=O)C1(NC(=O)c1ccco1)C(F)(F)F)Cc1ccccc1
STK774431
Synonyms: N-[6,6-dimethyl-2,4-dioxo-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]pyridine-3-carboxamide
Smiles: O=C(c1cccnc1)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)Cc1cccnc1)C(F)(F)F
STK774432
Synonyms: N-[6,6-dimethyl-2,4-dioxo-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]furan-2-carboxamide
Smiles: O=C1CC(C)(C)CC2=C1C(NC(=O)c1ccco1)(C(=O)N2Cc1cccnc1)C(F)(F)F
STK774434
Synonyms: N-[2,5-dioxo-1-(pyridin-3-ylmethyl)-4-(trifluoromethyl)imidazolidin-4-yl]-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)NC1(NC(=O)N(C1=O)Cc1cccnc1)C(F)(F)F
STK774435
Synonyms: N-[1-(2-chlorobenzyl)-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)Cc1ccccc1Cl)C(F)(F)F
STK774436
Synonyms: 4-fluoro-N-[1-(4-fluorobenzyl)-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]benzamide
Smiles: Fc1ccc(cc1)CN1C2=C(C(C1=O)(NC(=O)c1ccc(cc1)F)C(F)(F)F)C(=O)CC(C2)(C)C
STK774437
Synonyms: N-[6,6-dimethyl-2,4-dioxo-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-4-fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)Cc1cccnc1)C(F)(F)F
STK774441
Synonyms: 4-(4-methylphenyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CCCSc1nnc(s1)N1C(=O)CC(C2=C1CCCC2=O)c1ccc(cc1)C
STK774442
Synonyms: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2-fluorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(C2=C(N1c1nnc(s1)SCc1ccccc1Cl)CCCC2=O)c1ccccc1F
STK774444
Synonyms: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(4-fluorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Fc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)c1nnc(s1)SCc1ccccc1
STK774445
Synonyms: 3-(5-bromofuran-2-yl)-5-[(4-chloro-2-methylphenoxy)methyl]-1,2,4-oxadiazole
Smiles: Clc1ccc(c(c1)C)OCc1onc(n1)c1ccc(o1)Br
STK774447
Synonyms: methyl4-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)c1onc(n1)c1cccs1
STK774448
Synonyms: 5-(4-methyl-3-nitrophenyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
Smiles: [O-][N+](=O)c1cc(ccc1C)c1onc(n1)c1cccs1
STK774450
Synonyms: 7-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-phenyl-5-propyl[1,3]thiazolo[4,5-d]pyrimidine-2(3H)-thione
Smiles: CCCc1nc(Sc2nccn2C)c2c(n1)n(c1ccccc1)c(=S)s2
STK774451
Synonyms: 5-(4-chlorophenoxy)-1-phenyl-1H-tetrazole
Smiles: Clc1ccc(cc1)Oc1nnnn1c1ccccc1
STK774452
Synonyms: 3-[2-(2,7-dimethyl-1H-indol-3-yl)ethyl]-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(N1CCc1c(C)[nH]c3c1cccc3C)(C)O)CCCCC2
STK774453
Synonyms: 1-(4-{3-[4-(3-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropoxy}phenyl)propan-1-one
Smiles: CCC(=O)c1ccc(cc1)OCC(CN1CCN(CC1)c1cccc(c1C)Cl)O
STK774455
Synonyms: 3-[2-(5-bromo-2-methyl-1H-indol-3-yl)ethyl]-4-hydroxy-4-methyl-1-oxa-3-azaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(N1CCc1c(C)[nH]c3c1cc(Br)cc3)(C)O)CCCCC2
STK774460
Synonyms: 7,8-difluoro-1,2,3,4-tetrahydrophenazine5,10-dioxide
Smiles: Fc1cc2[n+]([O-])c3CCCCc3[n+](c2cc1F)[O-]
STK774461
Synonyms: ethyl2-[(methoxycarbonyl)amino]-4-methyl-5-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)OC)sc(c1C)c1ccccc1
STK774465
Synonyms: N-[2-(methylsulfanyl)phenyl]-2-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}acetamide
Smiles: CSc1ccccc1NC(=O)COc1nsnc1N1CCOCC1
STK774467
Synonyms: 2-[(4-chlorophenoxy)methyl]-1-methyl-1H-indole-3-carbonitrile
Smiles: N#Cc1c(COc2ccc(cc2)Cl)n(c2c1cccc2)C
STK774469
Synonyms: 2-(4-chlorobenzyl)-5-{4-[(2-fluorobenzyl)oxy]phenyl}-2H-tetrazole
Smiles: Clc1ccc(cc1)Cn1nnc(n1)c1ccc(cc1)OCc1ccccc1F
STK774471
Synonyms: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2-methylphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(C2=C(N1c1nnc(s1)SCc1ccccc1Cl)CCCC2=O)c1ccccc1C
STK774472
Synonyms: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(2-chlorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(C2=C(N1c1nnc(s1)SCc1ccccc1Cl)CCCC2=O)c1ccccc1Cl
STK774474
Synonyms: 4-(2-fluorophenyl)-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CCCC2=O)c1ccccc1F
STK774475
Synonyms: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(4-fluorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Fc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)c1nnc(s1)SCc1ccccc1Cl
STK774476
Synonyms: 4-(2-fluorophenyl)-7,7-dimethyl-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccccc1F
STK774477
Synonyms: 4-(2-chlorophenyl)-7,7-dimethyl-1-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccccc1Cl
STK774479
Synonyms: N,N,2,5-tetramethylthiophene-3-sulfonamide
Smiles: Cc1sc(c(c1)S(=O)(=O)N(C)C)C
STK774481
Synonyms: 4-{4-[(2,5-dimethylthiophen-3-yl)sulfonyl]piperazin-1-yl}phenol
Smiles: Oc1ccc(cc1)N1CCN(CC1)S(=O)(=O)c1cc(sc1C)C
STK774482
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
Smiles: O=C(Cn1cnc(n1)[N+](=O)[O-])Nc1ccc(c(c1)C(F)(F)F)Cl
STK774483
Synonyms: (5Z)-5-[(2E)-(4-methoxybenzylidene)hydrazinylidene]-7,7-dimethyl-5,6,7,8-tetrahydrocinnolin-3(2H)-one
Smiles: COc1ccc(cc1)/C=N/N=C\1/CC(C)(C)Cc2c1cc(=O)[nH]n2
STK774486
Synonyms: N-[6,6-dimethyl-2,4-dioxo-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-3-methylbenzamide
Smiles: Cc1cccc(c1)C(=O)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)Cc1cccnc1)C(F)(F)F
STK774488
Synonyms: ethyl1-cyclohexyl-4-{[(3-methoxyphenyl)carbonyl]amino}-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(C)N(C(=O)C1(NC(=O)c1cccc(c1)OC)C(F)(F)F)C1CCCCC1
STK774489
Synonyms: N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl]-3-methoxybenzamide
Smiles: N#CC1=C(C)NC(=O)C1(NC(=O)c1cccc(c1)OC)C(F)(F)F
STK774490
Synonyms: ethyl1-cyclohexyl-4-{[(2-methoxyphenyl)carbonyl]amino}-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(C)N(C(=O)C1(NC(=O)c1ccccc1OC)C(F)(F)F)C1CCCCC1
STK774491
Synonyms: 2-(4-chlorophenyl)-5-methoxy-4-(trifluoromethyl)-1,3-oxazole
Smiles: COc1oc(nc1C(F)(F)F)c1ccc(cc1)Cl
STK774493
Synonyms: 4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl4-nitrobenzoate
Smiles: Cc1cc(cc(c1OC(=O)c1ccc(cc1)[N+](=O)[O-])C)C(C(F)(F)F)(C(F)(F)F)O
STK774494
Synonyms: 4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl2-fluorobenzoate
Smiles: Cc1cc(cc(c1OC(=O)c1ccccc1F)C)C(C(F)(F)F)(C(F)(F)F)O
STK774496
Synonyms: 4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O
STK774498
Synonyms: 2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4,5-dimethylphenylacetate
Smiles: CC(=O)Oc1cc(C)c(cc1C(C(F)(F)F)(C(F)(F)F)O)C
STK774499
Synonyms: 2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4-methylphenylacetate
Smiles: CC(=O)Oc1ccc(cc1C(C(F)(F)F)(C(F)(F)F)O)C
STK774500
Synonyms: N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)Nc1c(C)cc(cc1C)C(C(F)(F)F)(C(F)(F)F)O
STK774501
Synonyms: N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-2,6-dimethylphenyl]thiophene-2-carboxamide
Smiles: Cc1cc(cc(c1NC(=O)c1cccs1)C)C(C(F)(F)F)(C(F)(F)F)O
STK774503
Synonyms: N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O
STK774504
Synonyms: 7-methyl-3-oxo-2-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazin-2-yl2-methylprop-2-enoate
Smiles: Cc1ccc2c(c1)OC(C(=O)N2)(OC(=O)C(=C)C)C(F)(F)F
STK774505
Synonyms: 2-[4-(5-acetyl-1-hydroxy-4-methyl-1H-imidazol-2-yl)-2-ethoxyphenoxy]-N-phenylacetamide
Smiles: CCOc1cc(ccc1OCC(=O)Nc1ccccc1)c1nc(c(n1O)C(=O)C)C
STK774506
Synonyms: ethyl2-{[4,4,4-trifluoro-3-hydroxy-3-(trifluoromethyl)butanoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CC(C(F)(F)F)(C(F)(F)F)O)sc2c1CCCCC2
STK774507
Synonyms: ethyl6-methyl-2-{[4,4,4-trifluoro-3-hydroxy-3-(trifluoromethyl)butanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CC(C(F)(F)F)(C(F)(F)F)O)sc2c1CCC(C2)C
STK774508
Synonyms: ethyl5-(morpholin-4-ylmethyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCOCC1)c1nonc1n1cccc1
STK774509
Synonyms: 6-bromo-1a-(furan-2-ylcarbonyl)-1-methyl-1-[(4-methylphenyl)carbonyl]-1a,7b-dihydrocyclopropa[c]chromen-2(1H)-one
Smiles: Cc1ccc(cc1)C(=O)C1(C)C2C1(C(=O)Oc1c2cc(Br)cc1)C(=O)c1ccco1
STK774511
Synonyms: 4-(morpholin-4-ylmethyl)-2,6-di(propan-2-yl)phenol
Smiles: CC(c1cc(CN2CCOCC2)cc(c1O)C(C)C)C
STK774512
Synonyms: 1-(4-{3-[4-(3-chloro-2-methylphenyl)piperazin-1-yl]-2-hydroxypropoxy}-3-methoxyphenyl)ethanone
Smiles: COc1cc(ccc1OCC(CN1CCN(CC1)c1cccc(c1C)Cl)O)C(=O)C
STK774513
Synonyms: (3,4-dimethoxyphenyl)[4-(4-ethylphenyl)piperazin-1-yl]methanone
Smiles: CCc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc(c(c1)OC)OC
STK774515
Synonyms: ethyl4-methyl-5-phenyl-2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(OC)c(c(c2)OC)OC)sc(c1C)c1ccccc1
STK774518
Synonyms: 4-chloro-2-fluorobenzyl4-[2-(4-chloro-2-fluorobenzyl)-2H-tetrazol-5-yl]benzoate
Smiles: Clc1ccc(c(c1)F)COC(=O)c1ccc(cc1)c1nnn(n1)Cc1ccc(cc1F)Cl
STK774519
Synonyms: 3-[(2-chloro-6-fluorobenzyl)sulfanyl]-5-methyl-5H-[1,2,4]triazino[5,6-b]indole
Smiles: Fc1cccc(c1CSc1nnc2c(n1)n(C)c1c2cccc1)Cl
STK774520
Synonyms: 1-(9,10-dioxo-9,10-dihydroanthracen-1-yl)piperidine-3-carboxamide
Smiles: NC(=O)C1CCCN(C1)c1cccc2c1C(=O)c1ccccc1C2=O
STK774522
Synonyms: 1-(3-bromo-4-methylphenyl)-3-(4-methylbenzyl)pyrrolidine-2,5-dione
Smiles: Cc1ccc(cc1)CC1CC(=O)N(C1=O)c1ccc(c(c1)Br)C
STK774523
Synonyms: 3-(4-methylbenzyl)-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,5-dione
Smiles: Cc1ccc(cc1)CC1CC(=O)N(C1=O)c1ccc(cc1)OC(F)(F)F
STK774524
Synonyms: 3-(3,5-dimethylbenzyl)-1-[4-(trifluoromethoxy)phenyl]pyrrolidine-2,5-dione
Smiles: Cc1cc(cc(c1)C)CC1CC(=O)N(C1=O)c1ccc(cc1)OC(F)(F)F
STK774525
Synonyms: 1-(3-bromo-4-methylphenyl)-3-(3-methylbenzyl)pyrrolidine-2,5-dione
Smiles: Cc1cccc(c1)CC1CC(=O)N(C1=O)c1ccc(c(c1)Br)C
STK774526
Synonyms: 2-[3-(hexyloxy)phenyl]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: CCCCCCOc1cccc(c1)N1C(=O)C2C(C1=O)C1CC2C=C1
STK774527
Synonyms: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophen-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(c2cscc2)C2=C(N1c1nnc(s1)SCc1ccccc1)CCCC2=O
STK774528
Synonyms: 7,7-dimethyl-4-phenyl-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccccc1
STK774529
Synonyms: 1-{5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-7,7-dimethyl-4-phenyl-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Clc1ccc(cc1)CSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccccc1
STK774531
Synonyms: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl](3,4-dimethoxyphenyl)methanone
Smiles: COc1cc(ccc1OC)C(=O)N1CCN(CC1)c1nc2c(o1)cccc2
STK774536
Synonyms: 3,4-dimethyl-2-(morpholin-4-ylmethyl)-6-(1-phenylethyl)phenol
Smiles: Cc1c(C)cc(c(c1CN1CCOCC1)O)C(c1ccccc1)C
STK774537
Synonyms: 2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]-N-methyl-N-phenylacetamide
Smiles: O=C(N(c1ccccc1)C)CSc1nn2c(n1)nc(cc2C)C
STK774538
Synonyms: 2-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]-N-cyclohexylacetamide
Smiles: N#Cc1c(C)cc(nc1SCC(=O)NC1CCCCC1)C
STK774540
Synonyms: N-cyclohexyl-2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetamide
Smiles: O=C(NC1CCCCC1)CSc1nn2c(n1)nc(cc2C)C
STK774541
Synonyms: ethyl6-ethyl-4-hydroxy-4-methyl-2-thioxohexahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1C(CC)NC(=S)NC1(C)O
STK774544
Synonyms: 9-(furan-2-yl)-12-(4-propoxyphenyl)-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
Smiles: CCCOc1ccc(cc1)C1C2=C(CC(CC2=O)c2ccco2)Nc2c1c1ccccc1cc2
STK774545
Synonyms: 12-(1,3-benzodioxol-5-yl)-9-(furan-2-yl)-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
Smiles: O=C1CC(CC2=C1C(c1ccc3c(c1)OCO3)c1c(N2)ccc2c1cccc2)c1ccco1
STK774546
Synonyms: 12-[4-(diethylamino)phenyl]-9-(furan-2-yl)-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
Smiles: CCN(c1ccc(cc1)C1C2=C(CC(CC2=O)c2ccco2)Nc2c1c1ccccc1cc2)CC
STK774547
Synonyms: 12-(3,4-dimethoxyphenyl)-9-(furan-2-yl)-8,9,10,12-tetrahydrobenzo[a]acridin-11(7H)-one
Smiles: COc1ccc(cc1OC)C1C2=C(CC(CC2=O)c2ccco2)Nc2c1c1ccccc1cc2
STK774549
Synonyms: methyl6-acetyl-7-(4-methylphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylate
Smiles: COC(=O)C1=C(C(=O)C)C(n2c(N1)nnn2)c1ccc(cc1)C
STK774550
Synonyms: 2-methyl-N-(pyridin-3-yl)-2,3-dihydro-1H-indole-1-carbothioamide
Smiles: S=C(N1C(C)Cc2c1cccc2)Nc1cccnc1
STK774551
Synonyms: N-(4-acetylphenyl)-2-methyl-2,3-dihydro-1H-indole-1-carbothioamide
Smiles: CC1Cc2c(N1C(=S)Nc1ccc(cc1)C(=O)C)cccc2
STK774553
Synonyms: N-tert-butyl-2-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanyl]acetamide
Smiles: O=C(NC(C)(C)C)CSc1nn2c(n1)nc(cc2C)C
STK774556
Synonyms: ethylN-cyano-N-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]glycinate
Smiles: CCOC(=O)CN(c1nc(nc(n1)N1CCCCC1)N1CCCCC1)C#N
STK774557
Synonyms: [4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]prop-2-en-1-ylcyanamide
Smiles: C=CCN(c1nc(nc(n1)N1CCCCC1)N1CCCCC1)C#N
STK774559
Synonyms: 2-acetyl-1-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazinecarboxamide
Smiles: CC(=O)NN(c1nc(nc(n1)N1CCOCC1)N1CCOCC1)C(=O)N
STK774560
Synonyms: methyl1-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
Smiles: COC(=O)c1nnn(c1C)c1nc(nc(n1)N1CCOCC1)N1CCOCC1
STK774561
Synonyms: 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-4-(furan-2-yl)-6-phenylpyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2nc3c([nH]2)cccc3)nc(cc1c1ccco1)c1ccccc1
STK774562
Synonyms: 4-(methoxymethyl)-6-methyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbohydrazide
Smiles: COCc1cc(C)nc2c1c(n1cccc1)c(s2)C(=O)NN
STK774563
Synonyms: N-(4-chlorobenzyl)-3-{[(2-chlorophenyl)carbonyl]amino}-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
Smiles: Clc1ccc(cc1)CNC(=O)c1sc2c(c1NC(=O)c1ccccc1Cl)c(C)cc(n2)C
STK774564
Synonyms: N-(4-fluorophenyl)-3-{[(2-methoxyphenyl)carbonyl]amino}-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1ccccc1C(=O)Nc1c(sc2c1c(C)cc(n2)C)C(=O)Nc1ccc(cc1)F
STK774565
Synonyms: 4,6-dimethyl-3-{[(4-methylphenyl)carbonyl]amino}-N-(2-phenylethyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: Cc1ccc(cc1)C(=O)Nc1c(sc2c1c(C)cc(n2)C)C(=O)NCCc1ccccc1
STK774566
Synonyms: N-{3-[(3-cyano-4,6-dimethylpyridin-2-yl)oxy]phenyl}naphthalene-2-sulfonamide
Smiles: N#Cc1c(C)cc(nc1Oc1cccc(c1)NS(=O)(=O)c1ccc2c(c1)cccc2)C
STK774567
Synonyms: N-{3-[(3-cyano-4,6-dimethylpyridin-2-yl)oxy]phenyl}-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)Nc1cccc(c1)Oc1nc(C)cc(c1C#N)C
STK774568
Synonyms: 5-chloro-3-cyano-N,4,6-trimethyl-N-phenylpyridine-2-sulfonamide
Smiles: N#Cc1c(C)c(Cl)c(nc1S(=O)(=O)N(c1ccccc1)C)C
STK774574
Synonyms: 1-(4-hydroxy-4-methyl-2-thioxohexahydropyrimidin-5-yl)ethanone
Smiles: S=C1NCC(C(N1)(C)O)C(=O)C
STK774576
Synonyms: 2-(4-bromophenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(cc1)Br)CCC
STK774578
Synonyms: 2,2-dimethyl-5-(morpholin-4-yl)-8-(pyrrolidin-1-yl)-1,4-dihydro-2H-thiopyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazine
Smiles: CC1(C)SCc2c(C1)c1c(nc2N2CCOCC2)sc2c1nnnc2N1CCCC1
STK774580
Synonyms: 4-amino-1-sulfanyl[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Smiles: Nn1c(=O)c2ccccc2n2c1nnc2S
STK774583
Synonyms: 1-amino-9-ethyl-9-methyl-5-phenyl-5,7,9,10-tetrahydro-6H-pyrano[4',3':4,5]pyrido[2,3-d]pyrimidin-6-one
Smiles: CCC1(C)OCc2c(C1)c1c(N)ncnc1n(c2=O)c1ccccc1
STK774584
Synonyms: 3-amino-1-oxo-2-phenyl-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(N)n(c2ccccc2)c(=O)c2c1CCCC2
STK774585
Synonyms: N-(2-chlorophenyl)-7,7-dimethyl-2-oxo-1,8-dioxaspiro[4.5]decane-4-carboxamide
Smiles: O=C1CC(C2(O1)CCOC(C2)(C)C)C(=O)Nc1ccccc1Cl
STK774587
Synonyms: methyl2-[({[5,7-bis(ethylamino)[1,2,4]triazolo[4,3-a][1,3,5]triazin-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: CCNc1nc(NCC)nc2n1c(SCC(=O)Nc1ccccc1C(=O)OC)nn2
STK774588
Synonyms: 3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-5-(3-methoxyphenyl)cyclohex-2-en-1-one
Smiles: COc1cccc(c1)C1CC(=CC(=O)C1)NCCc1ccc(c(c1)OC)OC
STK774589
Synonyms: 4-phenyl-1-(5-{[3-(trifluoromethyl)benzyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(c2ccccc2)C2=C(N1c1nnc(s1)SCc1cccc(c1)C(F)(F)F)CCCC2=O
STK774590
Synonyms: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(4-methylphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: Cc1ccc(cc1)C1CC(=O)N(C2=C1C(=O)CCC2)c1nnc(s1)SCc1ccccc1Cl
STK774591
Synonyms: 4-(2,3-dichlorophenyl)-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CCCSc1nnc(s1)N1C(=O)CC(C2=C1CCCC2=O)c1cccc(c1Cl)Cl
STK774592
Synonyms: 4-(2,3-dichlorophenyl)-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CCCC2=O)c1cccc(c1Cl)Cl
STK774593
Synonyms: 4-(2-chlorophenyl)-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CCCC2=O)c1ccccc1Cl
STK774594
Synonyms: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(2-fluorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(C2=C(N1c1nnc(s1)SCc1ccccc1)CCCC2=O)c1ccccc1F
STK774596
Synonyms: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(c2cccs2)C2=C(N1c1nnc(s1)SCc1ccccc1)CCCC2=O
STK774597
Synonyms: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CCCC2=C1C(CC(=O)N2c1nnc(s1)SCc1ccccc1Cl)c1cccs1
STK774598
Synonyms: 1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-(thiophen-3-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CCCC2=O)c1cscc1
STK774599
Synonyms: 4-(2-chlorophenyl)-7,7-dimethyl-1-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: C=CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccccc1Cl
STK774600
Synonyms: 1-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-7,7-dimethyl-4-(3-nitrophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1cccc(c1)[N+](=O)[O-]
STK774601
Synonyms: 7,7-dimethyl-4-phenyl-1-[5-(propylsulfanyl)-1,3,4-thiadiazol-2-yl]-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: CCCSc1nnc(s1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccccc1
STK774602
Synonyms: N-(4-ethoxyphenyl)-2-[5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophen-2-yl]-1,3-thiazolidine-3-carbothioamide
Smiles: CCOc1ccc(cc1)NC(=S)N1CCSC1c1ccc(s1)C#CC(O)(C)C
STK774604
Synonyms: (2Z)-N-benzyl-2-{[2-(4-bromophenyl)-2-oxoethoxy]imino}-2-cyanoethanamide
Smiles: N#C/C(=N/OCC(=O)c1ccc(cc1)Br)/C(=O)NCc1ccccc1
STK774605
Synonyms: 1-(4-bromo-3-methylphenyl)-3-pyridin-3-ylthiourea
Smiles: S=C(Nc1cccnc1)Nc1ccc(c(c1)C)Br
STK774606
Synonyms: 1,1'-(2,5-dichlorobenzene-1,4-diyl)bis[3-(3,5-dimethylphenyl)(thiourea)]
Smiles: S=C(Nc1cc(C)cc(c1)C)Nc1cc(Cl)c(cc1Cl)NC(=S)Nc1cc(C)cc(c1)C
STK774607
Synonyms: 1-(3-fluoro-4-methylphenyl)-3-[2-(morpholin-4-yl)ethyl]thiourea
Smiles: S=C(Nc1ccc(c(c1)F)C)NCCN1CCOCC1
STK774608
Synonyms: 2-ethyl-N-[2-(propan-2-yl)phenyl]piperidine-1-carbothioamide
Smiles: CCC1CCCCN1C(=S)Nc1ccccc1C(C)C
STK774609
Synonyms: N-(4-acetylphenyl)-2-ethylpiperidine-1-carbothioamide
Smiles: CCC1CCCCN1C(=S)Nc1ccc(cc1)C(=O)C
STK774611
Synonyms: N-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Smiles: Cc1ccc2c(c1)c(CCNS(=O)(=O)c1ccc3c(c1)OCCO3)c([nH]2)C
STK774612
Synonyms: 2-{[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc(=O)cc(n1CCc1ccccc1)N
STK774614
Synonyms: 4-(methylamino)-6-(morpholin-4-yl)-1,3,5-triazine-2-carboxamide
Smiles: CNc1nc(nc(n1)C(=O)N)N1CCOCC1
STK774615
Synonyms: 1-[2-fluoro-4-nitro-5-(piperidin-1-yl)phenyl]azepane
Smiles: Fc1cc([N+](=O)[O-])c(cc1N1CCCCCC1)N1CCCCC1
STK774616
Synonyms: 4-fluoro-5-(morpholin-4-yl)-2-nitro-N-(tetrahydrofuran-2-ylmethyl)aniline
Smiles: [O-][N+](=O)c1cc(F)c(cc1NCC1CCCO1)N1CCOCC1
STK774617
Synonyms: [4-(2-fluoro-5-methyl-4-nitrophenyl)-2-methylpiperazin-1-yl](thiophen-2-yl)methanone
Smiles: CC1CN(CCN1C(=O)c1cccs1)c1cc(C)c(cc1F)[N+](=O)[O-]
STK774619
Synonyms: methyl2-methyl-4-{[(2-methylphenyl)carbonyl]amino}-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: COC(=O)C1=C(C)NC(=O)C1(NC(=O)c1ccccc1C)C(F)(F)F
STK774622
Synonyms: (2-chloro-5,6-difluoro-3-methylphenyl)(3,4-dihydroquinolin-1(2H)-yl)methanone
Smiles: O=C(c1c(Cl)c(C)cc(c1F)F)N1CCCc2c1cccc2
STK774623
Synonyms: 2,3-difluoro-4-methyl-N-(tetrahydrofuran-2-ylmethyl)benzamide
Smiles: O=C(c1ccc(c(c1F)F)C)NCC1CCCO1
STK774624
Synonyms: 2-thioxo-1,2,3,4-tetrahydro-5H-6,1,3-benzoxadiazocin-5-one
Smiles: S=C1NCC(=O)Oc2c(N1)cccc2
STK774627
Synonyms: 2-amino-4-(5-tert-butylthiophen-2-yl)-1-(dimethylamino)-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1ccc(s1)C(C)(C)C)C(=O)CC(C2)c1ccccc1
STK774629
Synonyms: ethyl2-[(3-oxo-5-phenylcyclohex-1-en-1-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC2=CC(=O)CC(C2)c2ccccc2)sc2c1CCCC2
STK774630
Synonyms: 3-[(4-fluoro-3-nitrophenyl)amino]cyclohex-2-en-1-one
Smiles: O=C1CCCC(=C1)Nc1ccc(c(c1)[N+](=O)[O-])F
STK774631
Synonyms: 3-(2,2-dimethylhydrazinyl)-5-phenylcyclohex-2-en-1-one
Smiles: CN(NC1=CC(=O)CC(C1)c1ccccc1)C
STK774632
Synonyms: 2'-amino-1'-(4-ethylphenyl)-2,5'-dioxo-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2)CC)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CCC2
STK774633
Synonyms: 2'-amino-1'-(4-fluorophenyl)-7',7'-dimethyl-2,5'-dioxo-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(cc2)F)C2=C(C31C(=O)Nc1c3cccc1)C(=O)CC(C2)(C)C
STK774641
Synonyms: N-[1-(4-hydroxyphenyl)ethyl]-2-(thiophen-2-yl)acetamide
Smiles: O=C(NC(c1ccc(cc1)O)C)Cc1cccs1
STK774642
Synonyms: 2-amino-1-(dimethylamino)-7,7-dimethyl-4-(3-methyl-1-benzothiophen-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(N(C)C)C2=C(C1c1sc3c(c1C)cccc3)C(=O)CC(C2)(C)C
STK774645
Synonyms: ethyl2-[(3-oxocyclohex-1-en-1-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC2=CC(=O)CCC2)sc2c1CCCC2
STK774646
Synonyms: N-(2-hydroxy-2-phenylethyl)-2-methyl-1,3-benzoxazole-7-carboxamide
Smiles: Cc1nc2c(o1)c(ccc2)C(=O)NCC(c1ccccc1)O
STK774648
Synonyms: 2-methyl-N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-1,3-benzoxazole-7-carboxamide
Smiles: Cc1nc2c(o1)c(ccc2)C(=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(F)(F)F
STK774651
Synonyms: 1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-phenyl-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CC(c2ccccc2)C2=C(N1c1nnc(s1)SCc1ccccc1Cl)CCCC2=O
STK774652
Synonyms: 1-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-4-phenyl-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Smiles: O=C1CCCC2=C1C(CC(=O)N2c1nnc(s1)SCc1ccccc1)c1ccccc1
STK774653
Synonyms: 6-(diphenylamino)-4-ethoxy-1,3,5-triazin-2(1H)-one
Smiles: CCOc1nc([nH]c(=O)n1)N(c1ccccc1)c1ccccc1
STK774655
Synonyms: 4-(diphenylamino)-6-ethoxy-N'-hydroxy-1,3,5-triazine-2-carboximidamide
Smiles: CCOc1nc(nc(n1)N(c1ccccc1)c1ccccc1)/C(=N\O)/N
STK774656
Synonyms: 4-ethoxy-N,N-diphenyl-6-(pyridin-2-ylsulfanyl)-1,3,5-triazin-2-amine
Smiles: CCOc1nc(Sc2ccccn2)nc(n1)N(c1ccccc1)c1ccccc1
STK774657
Synonyms: N,N-dibenzyl-5-chloro-4,6-dimethyl-3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1n1cccc1)c(C)c(c(n2)C)Cl)N(Cc1ccccc1)Cc1ccccc1
STK774658
Synonyms: 9-(furan-2-yl)-7-phenyl-3-[2-(trifluoromethyl)phenyl]pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4(3H)-one
Smiles: O=c1c2sc3c(c2nnn1c1ccccc1C(F)(F)F)c(cc(n3)c1ccccc1)c1ccco1
STK774659
Synonyms: 2-(5-bromofuran-2-yl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Smiles: COCc1cc(C)nc2c1c1NC(NC(=O)c1s2)c1ccc(o1)Br
STK774662
Synonyms: 2-[(6-methyl-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1nc(C)cc2c1C(=O)OC2
STK774664
Synonyms: 2-[(6-methyl-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl)sulfanyl]-N-(quinolin-8-yl)acetamide
Smiles: O=C(Nc1cccc2c1nccc2)CSc1nc(C)cc2c1C(=O)OC2
STK774668
Synonyms: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(6-methyl-3-oxo-1,3-dihydrofuro[3,4-c]pyridin-4-yl)sulfanyl]acetamide
Smiles: CCOc1cc(CCNC(=O)CSc2nc(C)cc3c2C(=O)OC3)ccc1OCC
STK774669
Synonyms: N-(2-chlorobenzyl)-2-[(5-chloro-3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetamide
Smiles: N#Cc1c(SCC(=O)NCc2ccccc2Cl)nc(c(c1C)Cl)C
STK774670
Synonyms: N-(2-chlorobenzyl)-2-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetamide
Smiles: N#Cc1c(C)cc(nc1SCC(=O)NCc1ccccc1Cl)C
STK774671
Synonyms: N-(2-chlorobenzyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)acetamide
Smiles: O=C(CSc1nnc[nH]1)NCc1ccccc1Cl
STK774672
Synonyms: N-{3-[(3-cyano-4,6-dimethylpyridin-2-yl)oxy]phenyl}-8-methoxyquinoline-5-sulfonamide
Smiles: N#Cc1c(C)cc(nc1Oc1cccc(c1)NS(=O)(=O)c1ccc(c2c1cccn2)OC)C
STK774673
Synonyms: N-(2-ethylphenyl)-8-methoxyquinoline-5-sulfonamide
Smiles: CCc1ccccc1NS(=O)(=O)c1ccc(c2c1cccn2)OC
STK774674
Synonyms: N-{3-[(3-cyano-4,6-dimethyl-5-nitropyridin-2-yl)oxy]phenyl}propanamide
Smiles: CCC(=O)Nc1cccc(c1)Oc1nc(C)c(c(c1C#N)C)[N+](=O)[O-]
STK774676
Synonyms: N-{3-[(3-cyano-4,6-dimethylpyridin-2-yl)oxy]phenyl}-4-methylbenzamide
Smiles: N#Cc1c(C)cc(nc1Oc1cccc(c1)NC(=O)c1ccc(cc1)C)C
STK774678
Synonyms: 5-chloro-3-cyano-N-ethyl-4,6-dimethyl-N-phenylpyridine-2-sulfonamide
Smiles: N#Cc1c(C)c(Cl)c(nc1S(=O)(=O)N(c1ccccc1)CC)C
STK774679
Synonyms: N-tert-butyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)S(=O)(=O)NC(C)(C)C
STK774681
Synonyms: ethylN-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-N-cyanoglycinate
Smiles: CCOC(=O)CN(c1nc(nc(n1)N(C)C)N(C)C)C#N
STK774682
Synonyms: 4,6-bis(dimethylamino)-1,3,5-triazin-2(1H)-one
Smiles: O=c1nc(nc([nH]1)N(C)C)N(C)C
STK774683
Synonyms: methyl1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
Smiles: COC(=O)c1nnn(c1C)c1nc(nc(n1)N(C)C)N(C)C
STK774684
Synonyms: ethyl1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1C)c1nc(nc(n1)N(C)C)N(C)C
STK774685
Synonyms: [4,6-bis(dimethylamino)-1,3,5-triazin-2-yl](4-chlorobenzyl)cyanamide
Smiles: N#CN(c1nc(nc(n1)N(C)C)N(C)C)Cc1ccc(cc1)Cl
STK774686
Synonyms: N,N,N',N'-tetramethyl-6-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-1,3,5-triazine-2,4-diamine
Smiles: CN(c1nc(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc(n1)N(C)C)C
STK774687
Synonyms: 1-[4-(diphenylamino)-6-ethoxy-1,3,5-triazin-2-yl]hydrazinecarboxamide
Smiles: CCOc1nc(nc(n1)N(c1ccccc1)c1ccccc1)N(C(=O)N)N
STK774688
Synonyms: 6-ethoxy-N,N-diphenyl-1,3,5-triazine-2,4-diamine
Smiles: CCOc1nc(N)nc(n1)N(c1ccccc1)c1ccccc1
STK774689
Synonyms: methyl1-[4-(diphenylamino)-6-ethoxy-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOc1nc(nc(n1)n1nnc(c1C)C(=O)OC)N(c1ccccc1)c1ccccc1
STK774690
Synonyms: ethyl1-[4-(diphenylamino)-6-ethoxy-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1C)c1nc(OCC)nc(n1)N(c1ccccc1)c1ccccc1
STK774691
Synonyms: 1-{1-[4-(diphenylamino)-6-ethoxy-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazol-4-yl}ethanone
Smiles: CCOc1nc(nc(n1)N(c1ccccc1)c1ccccc1)n1nnc(c1C)C(=O)C
STK774692
Synonyms: 3-{[(2-chlorophenyl)carbonyl]amino}-N,4,5,6-tetramethyl-N-phenylthieno[2,3-b]pyridine-2-carboxamide
Smiles: Clc1ccccc1C(=O)Nc1c(sc2c1c(C)c(c(n2)C)C)C(=O)N(c1ccccc1)C
STK774694
Synonyms: N-(4-fluorophenyl)-4,6-dimethyl-3-[(phenylcarbonyl)amino]thieno[2,3-b]pyridine-2-carboxamide
Smiles: Fc1ccc(cc1)NC(=O)c1sc2c(c1NC(=O)c1ccccc1)c(C)cc(n2)C
STK774695
Synonyms: methyl5-methyl-1-[4-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]-1H-1,2,3-triazole-4-carboxylate
Smiles: COC(=O)c1nnn(c1C)c1nc(nc(n1)N1CCOCC1)N1CCCCC1
STK774696
Synonyms: 1-[4-ethoxy-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]hydrazinecarboxamide
Smiles: CCOc1nc(nc(n1)N(C(=O)N)N)N1CCOCC1
STK774697
Synonyms: methyl1-[4-ethoxy-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOc1nc(nc(n1)n1nnc(c1C)C(=O)OC)N1CCOCC1
STK774698
Synonyms: ethyl1-[4-ethoxy-6-(morpholin-4-yl)-1,3,5-triazin-2-yl]-5-phenyl-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccccc1)c1nc(OCC)nc(n1)N1CCOCC1
STK774700
Synonyms: 4-ethoxy-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
Smiles: CCOc1nc(nc(n1)N)N1CCOCC1
STK774707
Synonyms: ethyl1-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]-5-phenyl-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1c1ccccc1)c1nc(nc(n1)N1CCCCC1)N1CCCCC1
STK774708
Synonyms: 2-{[5-(2-ethoxy-2-oxoethyl)-1,3,4-thiadiazol-2-yl]amino}-2-oxoethyl2-phenylquinoline-4-carboxylate
Smiles: CCOC(=O)Cc1nnc(s1)NC(=O)COC(=O)c1cc(nc2c1cccc2)c1ccccc1
STK774709
Synonyms: N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)thiophene-2-carboxamide
Smiles: O=C(c1cccs1)NCC12CC3CC(C2)CC(C1)C3
STK774710
Synonyms: 5-(4-methoxyphenyl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: COc1ccc(cc1)c1cc(n2c(n1)c(cn2)C(=O)NCC12CC3CC(C2)CC(C1)C3)C(F)(F)F
STK774711
Synonyms: N~1~-(4-chlorophenyl)piperidine-1,3-dicarboxamide
Smiles: NC(=O)C1CCCN(C1)C(=O)Nc1ccc(cc1)Cl
STK774712
Synonyms: N~1~-(3,4-dichlorophenyl)piperidine-1,3-dicarboxamide
Smiles: NC(=O)C1CCCN(C1)C(=O)Nc1ccc(c(c1)Cl)Cl
STK774713
Synonyms: 1-(cyclopropylmethyl)-3-{2-[3-(prop-1-en-2-yl)phenyl]propan-2-yl}-1-propylurea
Smiles: CCCN(C(=O)NC(c1cccc(c1)C(=C)C)(C)C)CC1CC1
STK774714
Synonyms: 6-[(3-methylpyridin-2-yl)amino]-6-(trifluoromethyl)-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5(6H)-one
Smiles: O=C1N2CCSC2=NC1(Nc1ncccc1C)C(F)(F)F
STK774715
Synonyms: 4-(1H-imidazol-1-yl)-6-(2-methyl-1H-benzimidazol-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine
Smiles: Cc1nc2c(n1c1nc(nc(n1)N(c1ccccc1)c1ccccc1)n1ccnc1)cccc2
STK774717
Synonyms: 4-fluoro-N-[5-methyl-2-oxo-4-(phenylcarbonyl)-1-(2-phenylethyl)-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)NC1(C(=O)N(C(=C1C(=O)c1ccccc1)C)CCc1ccccc1)C(F)(F)F
STK774718
Synonyms: 6-(2-methyl-1H-benzimidazol-1-yl)-3-(pentafluoroethyl)[1,2,4]triazolo[3,4-a]phthalazine
Smiles: Cc1nc2c(n1c1nn3c(c4c1cccc4)nnc3C(C(F)(F)F)(F)F)cccc2
STK774720
Synonyms: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(6-nitro-1H-benzotriazol-1-yl)oxy]acetamide
Smiles: O=C(Nc1ccc(c(c1)C(F)(F)F)Cl)COn1nnc2c1cc(cc2)[N+](=O)[O-]
STK774722
Synonyms: methyl4-{[(4-fluorophenyl)carbonyl]amino}-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: COC(=O)C1=C(C)NC(=O)C1(NC(=O)c1ccc(cc1)F)C(F)(F)F
STK774725
Synonyms: methyl3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1cc(OC)c(c(c1)OC)OC
STK774726
Synonyms: 4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenoxy)-1-[2-(4-fluorophenyl)ethyl]azetidin-2-one
Smiles: Fc1ccc(cc1)CCN1C(=O)C(C1c1ccc2c(c1)OCO2)Oc1ccc(cc1)Cl
STK774728
Synonyms: cyclopentyl3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OC1CCCC1
STK774729
Synonyms: 2-methoxyethyl3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COCCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1cc(OC)c(c(c1)OC)OC
STK774730
Synonyms: 4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenoxy)-1-(4-fluorobenzyl)azetidin-2-one
Smiles: Fc1ccc(cc1)CN1C(=O)C(C1c1ccc2c(c1)OCO2)Oc1ccc(cc1)Cl
STK774732
Synonyms: cycloheptyl3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OC1CCCCCC1
STK774733
Synonyms: 2-propoxyethyl3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: CCCOCCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1cc(OC)c(c(c1)OC)OC
STK774734
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-(4-chlorobenzyl)-3-phenoxyazetidin-2-one
Smiles: Clc1ccc(cc1)CN1C(=O)C(C1c1ccc2c(c1)OCO2)Oc1ccccc1
STK774736
Synonyms: 4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenoxy)-1-[2-(4-chlorophenyl)ethyl]azetidin-2-one
Smiles: Clc1ccc(cc1)CCN1C(=O)C(C1c1ccc2c(c1)OCO2)Oc1ccc(cc1)Cl
STK774737
Synonyms: propan-2-yl3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OC(C)C
STK774738
Synonyms: 2-methylpropyl3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OCC(C)C
STK774740
Synonyms: methyl4-{3-(4-chlorophenoxy)-1-[2-(4-fluorophenyl)ethyl]-4-oxoazetidin-2-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(CCc2ccc(cc2)F)C(=O)C1Oc1ccc(cc1)Cl
STK774741
Synonyms: 4-(1,3-benzodioxol-5-yl)-3-(4-chlorophenoxy)-1-[2-(4-methoxyphenyl)ethyl]azetidin-2-one
Smiles: COc1ccc(cc1)CCN1C(=O)C(C1c1ccc2c(c1)OCO2)Oc1ccc(cc1)Cl
STK774742
Synonyms: ethyl3-(2-chlorophenyl)-3-{[(5-phenyl-2H-tetrazol-2-yl)acetyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccccc1Cl)NC(=O)Cn1nnc(n1)c1ccccc1
STK774744
Synonyms: N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-2,3-dihydro-1H-pyrrol-3-yl]-3-phenylpropanamide
Smiles: N#CC1=C(C)NC(=O)C1(NC(=O)CCc1ccccc1)C(F)(F)F
STK774746
Synonyms: N-[6,6-dimethyl-2,4-dioxo-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)NC1(C(=O)N(C2=C1C(=O)CC(C2)(C)C)Cc1cccnc1)C(F)(F)F
STK774748
Synonyms: 5-[1-(3-chlorophenoxy)ethyl]-3-(thiophen-2-yl)-1,2,4-oxadiazole
Smiles: Clc1cccc(c1)OC(c1onc(n1)c1cccs1)C
STK774749
Synonyms: 5-[(E)-2-(2-fluorophenyl)ethenyl]-3-(thiophen-2-yl)-1,2,4-oxadiazole
Smiles: Fc1ccccc1/C=C/c1onc(n1)c1cccs1
STK774750
Synonyms: 5-(2-methylfuran-3-yl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
Smiles: Cc1occc1c1onc(n1)c1cccs1
STK774751
Synonyms: 5-(2-nitrophenyl)-3-(thiophen-2-yl)-1,2,4-oxadiazole
Smiles: [O-][N+](=O)c1ccccc1c1onc(n1)c1cccs1
STK774755
Synonyms: 2-methoxyethyl2-amino-6-(hydroxymethyl)-8-oxo-4-phenyl-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: COCCOC(=O)C1=C(N)Oc2c(C1c1ccccc1)oc(cc2=O)CO
STK774756
Synonyms: 2-amino-1'-ethyl-7-methyl-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carbonitrile
Smiles: N#CC1=C(N)OC2=C(C31C(=O)N(c1c3cccc1)CC)C(=O)CC(C2)C
STK774757
Synonyms: 2-amino-7-methyl-2',5-dioxo-1'-propyl-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carbonitrile
Smiles: CCCN1c2ccccc2C2(C1=O)C(=C(N)OC1=C2C(=O)CC(C1)C)C#N
STK774758
Synonyms: 2-amino-7-methyl-2',5-dioxo-1'-(prop-2-en-1-yl)-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carbonitrile
Smiles: C=CCN1c2ccccc2C2(C1=O)C(=C(N)OC1=C2C(=O)CC(C1)C)C#N
STK774759
Synonyms: N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[(6-nitro-1H-benzotriazol-1-yl)oxy]acetamide
Smiles: O=C(Nc1ccc(cc1C(F)(F)F)Cl)COn1nnc2c1cc(cc2)[N+](=O)[O-]
STK774760
Synonyms: 2-[4-(5-acetyl-1-hydroxy-4-methyl-1H-imidazol-2-yl)-2-ethoxyphenoxy]-N-(4-fluorophenyl)acetamide
Smiles: CCOc1cc(ccc1OCC(=O)Nc1ccc(cc1)F)c1nc(c(n1O)C(=O)C)C
STK774763
Synonyms: N-(1,3-benzothiazol-2-yl)-4,4,4-trifluoro-3-hydroxy-3-(trifluoromethyl)butanamide
Smiles: O=C(CC(C(F)(F)F)(C(F)(F)F)O)Nc1nc2c(s1)cccc2
STK774764
Synonyms: 4,4,4-trifluoro-3-hydroxy-N-(4-phenoxyphenyl)-3-(trifluoromethyl)butanamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CC(C(F)(F)F)(C(F)(F)F)O
STK774766
Synonyms: 3-(3-chlorophenyl)-5-ethoxy-5-(trifluoromethyl)imidazolidine-2,4-dione
Smiles: CCOC1(NC(=O)N(C1=O)c1cccc(c1)Cl)C(F)(F)F
STK774767
Synonyms: 3-(3-chloro-4-fluorophenyl)-5-ethoxy-5-(trifluoromethyl)imidazolidine-2,4-dione
Smiles: CCOC1(NC(=O)N(C1=O)c1ccc(c(c1)Cl)F)C(F)(F)F
STK774768
Synonyms: N-[1-benzyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)NC1(C(=O)N(C2=C1C(=O)CCC2)Cc1ccccc1)C(F)(F)F
STK774769
Synonyms: N-[6,6-dimethyl-2,4-dioxo-1-(pyridin-3-ylmethyl)-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-3-phenylpropanamide
Smiles: O=C(NC1(C2=C(N(C1=O)Cc1cccnc1)CC(CC2=O)(C)C)C(F)(F)F)CCc1ccccc1
STK774771
Synonyms: methyl2-{[5-oxo-6-(trifluoromethyl)-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazol-6-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC1(N=C2N(C1=O)CCS2)C(F)(F)F
STK774772
Synonyms: N~1~-(naphthalen-1-yl)piperidine-1,3-dicarboxamide
Smiles: NC(=O)C1CCCN(C1)C(=O)Nc1cccc2c1cccc2
STK774775
Synonyms: N-(4-fluorobenzyl)-1-methyl-1H-pyrazole-4-carboxamide
Smiles: Fc1ccc(cc1)CNC(=O)c1cnn(c1)C
STK774776
Synonyms: N-(4-methoxy-2-methylphenyl)-1-methyl-1H-pyrazole-4-carboxamide
Smiles: COc1ccc(c(c1)C)NC(=O)c1cnn(c1)C
STK774777
Synonyms: 1-(3-chloro-2-methylphenyl)-4-[(2-methoxy-5-methylphenyl)sulfonyl]piperazine
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)Cl)C
STK774778
Synonyms: 1-(3-chloro-2-methylphenyl)-4-[(4-methoxynaphthalen-1-yl)sulfonyl]piperazine
Smiles: COc1ccc(c2c1cccc2)S(=O)(=O)N1CCN(CC1)c1cccc(c1C)Cl
STK774779
Synonyms: 1-[(4-tert-butylphenyl)sulfonyl]-4-(3-chloro-2-methylphenyl)piperazine
Smiles: Clc1cccc(c1C)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(C)(C)C
STK774780
Synonyms: 1-(3-chloro-2-methylphenyl)-4-[(4-ethoxyphenyl)sulfonyl]piperazine
Smiles: CCOc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1cccc(c1C)Cl
STK774781
Synonyms: 1-(3-chloro-2-methylphenyl)-4-[(3,4-dimethoxyphenyl)sulfonyl]piperazine
Smiles: COc1cc(ccc1OC)S(=O)(=O)N1CCN(CC1)c1cccc(c1C)Cl
STK774782
Synonyms: 1-(3-chloro-2-methylphenyl)-4-{[2-methoxy-5-(propan-2-yl)phenyl]sulfonyl}piperazine
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)Cl)C(C)C
STK774783
Synonyms: 1-(3-chloro-2-methylphenyl)-4-[(5-fluoro-2-methoxyphenyl)sulfonyl]piperazine
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)Cl)F
STK774784
Synonyms: 1-(5-chloro-2-methylphenyl)-4-[(5-fluoro-2-methoxyphenyl)sulfonyl]piperazine
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1cc(Cl)ccc1C)F
STK774785
Synonyms: 1-(5-chloro-2-methylphenyl)-4-[(2,5-diethoxyphenyl)sulfonyl]piperazine
Smiles: CCOc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1cc(Cl)ccc1C)OCC
STK774786
Synonyms: 4-{[(2-oxo-2H-chromen-6-yl)sulfonyl]amino}-N-(2-phenylethyl)benzamide
Smiles: O=c1ccc2c(o1)ccc(c2)S(=O)(=O)Nc1ccc(cc1)C(=O)NCCc1ccccc1
STK774787
Synonyms: N-[2-(2,5-dimethyl-1H-indol-3-yl)ethyl]-2,3-dihydrothieno[3,4-b][1,4]dioxine-5-carboxamide
Smiles: Cc1ccc2c(c1)c(CCNC(=O)c1scc3c1OCCO3)c([nH]2)C
STK774788
Synonyms: 2-{[6-amino-4-oxo-1-(2-phenylethyl)-1,4-dihydropyrimidin-2-yl]sulfanyl}-N-(naphthalen-1-yl)propanamide
Smiles: O=c1nc(SC(C(=O)Nc2cccc3c2cccc3)C)n(c(c1)N)CCc1ccccc1
STK774789
Synonyms: 2-[(4-methylphenyl)sulfonyl]-4-nitro-1,2-dihydronaphtho[1',2':6,7]oxepino[4,3,2-cd]indole
Smiles: Cc1ccc(cc1)S(=O)(=O)N1CC2=Cc3c(Oc4c2c1cc(c4)[N+](=O)[O-])ccc1c3cccc1
STK774790
Synonyms: (3Z)-3-(4-methylbenzylidene)-1-[(4-methylphenyl)sulfonyl]-4,6-dinitro-2,3-dihydro-1H-indole
Smiles: Cc1ccc(cc1)/C=C/1\CN(c2c1c(cc(c2)[N+](=O)[O-])[N+](=O)[O-])S(=O)(=O)c1ccc(cc1)C
STK774791
Synonyms: 2'-amino-1'-(2,4-difluorophenyl)-7',7'-dimethyl-2,5'-dioxo-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C31C(=O)Nc1c3cccc1)C(=O)CC(C2)(C)C)c1ccc(cc1F)F
STK774792
Synonyms: 4-chloro-N-[1-(4-hydroxyphenyl)ethyl]benzamide
Smiles: Oc1ccc(cc1)C(NC(=O)c1ccc(cc1)Cl)C
STK774793
Synonyms: 4-(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)-N-[4-(trifluoromethoxy)phenyl]benzamide
Smiles: O=C(c1ccc(cc1)c1nn(C)c(=O)c2c1cccc2)Nc1ccc(cc1)OC(F)(F)F
STK774795
Synonyms: 17-ethyl-8H,16H-8,16-epiminodinaphtho[2,1-b:2',1'-f][1,5]dioxocine
Smiles: CCN1C2Oc3c(C1Oc1c2c2ccccc2cc1)c1ccccc1cc3
STK774796
Synonyms: 4-chloro-2,8-dimethyl-5-nitroquinoline
Smiles: Cc1cc(Cl)c2c(n1)c(C)ccc2[N+](=O)[O-]
STK774797
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-methyl-1,3-benzoxazole-7-carboxamide
Smiles: COc1cc(CCNC(=O)c2cccc3c2oc(n3)C)ccc1OC
STK774800
Synonyms: ethyl3-(4-methoxyphenyl)-3-{[(2-methyl-1,3-benzoxazol-7-yl)carbonyl]amino}propanoate
Smiles: CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)c1cccc2c1oc(n2)C
STK774802
Synonyms: 4-(1,3-benzodioxol-5-yl)-1-[2-(4-chlorophenyl)ethyl]-3-(2-methylphenoxy)azetidin-2-one
Smiles: Clc1ccc(cc1)CCN1C(=O)C(C1c1ccc2c(c1)OCO2)Oc1ccccc1C
STK774803
Synonyms: methyl4-{3-(4-chlorophenoxy)-1-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxoazetidin-2-yl}benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(CCc2ccc(c(c2)OC)OC)C(=O)C1Oc1ccc(cc1)Cl
STK774804
Synonyms: cyclohexylmethyl3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: COc1cc(cc(c1OC)OC)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OCC1CCCCC1
STK774805
Synonyms: ethyl3-methyl-4-oxo-6-(3,4,5-trimethoxyphenyl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1C)C(=O)CC(C2)c1cc(OC)c(c(c1)OC)OC
STK774806
Synonyms: methyl4-[3-(4-chlorophenoxy)-1-(4-fluorobenzyl)-4-oxoazetidin-2-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(Cc2ccc(cc2)F)C(=O)C1Oc1ccc(cc1)Cl
STK774807
Synonyms: methyl2-amino-4-(4-bromophenyl)-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-3-carboxylate
Smiles: COC(=O)C1=C(N)Oc2c(C1c1ccc(cc1)Br)oc(cc2=O)CO