FULL DB

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

STK526505
Synonyms: (2R,3R,10bS)-2-(4-methoxyphenyl)-3-(phenylcarbonyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccccc2)N2[C@H](C1(C#N)C#N)c1ccccc1C=C2

STK526506
Synonyms: 2-(dimethylamino)ethyl3-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: CN(CCOC(=O)CCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O)C

STK526507
Synonyms: N-{5-chloro-2-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-hydroxy-3,5-diiodobenzamide
Smiles: Clc1ccc(c(c1)NC(=O)c1cc(I)cc(c1O)I)Oc1ccc2c(c1Cl)cccc2

STK526508
Synonyms: 10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bistetrazolo[1,5-a:1',5'-c]pyrimidine
Smiles: C1CCc2c(C1)sc1c2c2nnnn2c2n1nnn2

STK526509
Synonyms: 4-{[(2-butoxyphenyl)carbonyl]amino}butanoicacid
Smiles: CCCCOc1ccccc1C(=O)NCCCC(=O)O

STK526511
Synonyms: 3-(4-ethoxyphenyl)-1,5-diphenyl-4,5-dihydro-1H-pyrazole
Smiles: CCOc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccccc1

STK526512
Synonyms: [(3,4-dimethoxybenzyl)amino]acetonitrile
Smiles: N#CCNCc1ccc(c(c1)OC)OC

STK526515
Synonyms: 7-{2,3-bis[(2-chloro-6-fluorobenzyl)oxy]propyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1cccc(c1COC(Cn1cnc2c1c(=O)n(C)c(=O)n2C)COCc1c(F)cccc1Cl)Cl

STK526517
Synonyms: 2-{[3-cyano-6-(4-fluorophenyl)-4-phenylpyridin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nc(cc1c1ccccc1)c1ccc(cc1)F

STK526519
Synonyms: 8-ethyl-6-[(2-hydroxyethyl)amino]-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Smiles: OCCNc1nc(CC)c2c(c1C#N)CC(SC2)(C)C

STK526520
Synonyms: 5-{(6-hydroxy-3-methyl-4-oxo-1-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidin-5-yl)[4-methoxy-3-(morpholin-4-ium-4-ylmethyl)phenyl]methyl}-3-methyl-6-oxo-1-phenyl-2-thioxo-1,2,3,6-tetrahydropyrimidin-4-o
Smiles: COc1ccc(cc1C[NH+]1CCOCC1)C(c1c([O-])n(C)c(=S)n(c1=O)c1ccccc1)c1c(O)n(c2ccccc2)c(=S)n(c1=O)C

STK526521
Synonyms: 8-ethyl-3,3-dimethyl-6-(morpholin-4-yl)-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(nc(c2c1CC(C)(C)SC2)CC)N1CCOCC1

STK526522
Synonyms: tert-butyl(8R,8aS)-6-amino-5,7,7-tricyano-8-(4-methoxyphenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: N#CC1=C(N)C([C@H]([C@H]2C1=CCN(C2)C(=O)OC(C)(C)C)c1ccc(cc1)OC)(C#N)C#N

STK526523
Synonyms: (2R,3R,10bS)-3-[(3,4-dimethoxyphenyl)carbonyl]-2-(4-methoxyphenyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Smiles: COc1ccc(cc1)[C@H]1[C@H](C(=O)c2ccc(c(c2)OC)OC)N2[C@H](C1(C#N)C#N)c1ccccc1C=C2

STK526524
Synonyms: octyl5-(acetyloxy)-6-bromo-2-[(carbamimidoylsulfanyl)methyl]-1-methyl-1H-indole-3-carboxylate
Smiles: CCCCCCCCOC(=O)c1c(CSC(=N)N)n(c2c1cc(OC(=O)C)c(c2)Br)C

STK526525
Synonyms: 1-[(4-ethoxybenzyl)oxy]guanidine
Smiles: CCOc1ccc(cc1)CONC(=N)N

STK526527
Synonyms: propan-2-yl{5-[3-(piperidin-1-yl)propanoyl]-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl}carbamate
Smiles: CC(OC(=O)Nc1ccc2c(c1)N(C(=O)CCN1CCCCC1)c1ccccc1CC2)C

STK526528
Synonyms: butyl{[5-cyano-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}acetate
Smiles: CCCCOC(=O)CSc1nc(N2CCOCC2)c2c(c1C#N)CC(OC2)(C)C

STK526531
Synonyms: diethyl(2-amino-1-{[(3,4-dichlorophenyl)carbamoyl]amino}-2-oxoethyl)phosphonate
Smiles: CCOP(=O)(C(C(=O)N)NC(=O)Nc1ccc(c(c1)Cl)Cl)OCC

STK526533
Synonyms: ethyl2-({[2-(4-benzylpiperazin-1-yl)-5-nitrophenyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(ccc2N2CCN(CC2)Cc2ccccc2)[N+](=O)[O-])sc2c1CCCC2

STK526534
Synonyms: N-benzyl-5-ethyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: CCc1nc2sc3c(c2c2c1CCCC2)ncnc3NCc1ccccc1

STK526535
Synonyms: 1,3-bis(4-ethoxybenzyl)thiourea
Smiles: CCOc1ccc(cc1)CNC(=S)NCc1ccc(cc1)OCC

STK526537
Synonyms: 9-benzyl-5-(ethylsulfanyl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCSc1nc2sc3c(c2c2n1cnn2)CCN(C3)Cc1ccccc1

STK526538
Synonyms: 4-bromo-2-{(E)-[(4-phenyl-1-{[(E)-phenylmethylidene]amino}-1H-imidazol-2-yl)imino]methyl}phenol
Smiles: Brc1ccc(c(c1)/C=N/c1nc(cn1/N=C/c1ccccc1)c1ccccc1)O

STK526540
Synonyms: 4-hydroxy-5-propoxypentanehydrazide
Smiles: CCCOCC(CCC(=O)NN)O

STK526542
Synonyms: ethyl[5-(N-cyclohexylglycyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate
Smiles: CCOC(=O)Nc1ccc2c(c1)N(C(=O)CNC1CCCCC1)c1ccccc1CC2

STK526543
Synonyms: ethyl(2Z)-5-[4-(acetyloxy)phenyl]-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C/1\c3ccccc3N(C1=O)CC)/s2

STK526544
Synonyms: 2-amino-4-(4-fluorophenyl)-7,7-dimethyl-3-nitro-4,6,7,8-tetrahydro-5H-chromen-5-one
Smiles: Fc1ccc(cc1)C1C2=C(OC(=C1[N+](=O)[O-])N)CC(CC2=O)(C)C

STK526545
Synonyms: 2-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)pyridine-3-carbonitrile
Smiles: N#Cc1ccc(nc1SCC(=O)C12CC3CC(C2)CC(C1)C3)C12CC3CC(C2)CC(C1)C3

STK526546
Synonyms: 1-[1-{5-[(2Z)-2-(4-chlorobenzylidene)hydrazinyl]-5-oxopentyl}-3-(4-chlorophenyl)-5,5-dimethyl-2-oxoimidazolidin-4-yl]-3-(4-chlorophenyl)-1-hydroxyurea
Smiles: O=C(N/N=C\c1ccc(cc1)Cl)CCCCN1C(=O)N(C(C1(C)C)N(C(=O)Nc1ccc(cc1)Cl)O)c1ccc(cc1)Cl

STK526547
Synonyms: N-{(2Z)-3-(4-nitrophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}-beta-alanine
Smiles: OC(=O)CCNC(=O)/C(=C/c1ccc(cc1)[N+](=O)[O-])/NC(=O)c1ccccc1

STK526548
Synonyms: 2-[(3,4-dichlorophenyl)amino]-2-oxoethyl[2-(2-methoxyphenoxy)ethyl]carbamodithioate
Smiles: COc1ccccc1OCCNC(=S)SCC(=O)Nc1ccc(c(c1)Cl)Cl

STK526550
Synonyms: 4-(4-methylphenyl)-1-[(2-methylprop-2-en-1-yl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCC3

STK526551
Synonyms: 3-(4-methoxyphenyl)-8,8-dimethyl-2-(methylsulfanyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)OC

STK526554
Synonyms: ethyl3-[(2Z)-azepan-2-ylideneamino]-4-carbamoyl-5-methylthiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1/N=C\1/CCCCCN1)C(=O)N)C

STK526555
Synonyms: 7-(4-acetylpiperazin-1-yl)-1-cyclopropyl-6-nitro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CC(=O)N1CCN(CC1)c1cc2n(cc(c(=O)c2cc1[N+](=O)[O-])C(=O)O)C1CC1

STK526556
Synonyms: 4-(4-benzylpiperazin-1-yl)-N-(4-chlorophenyl)-3-nitrobenzamide
Smiles: Clc1ccc(cc1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)Cc1ccccc1

STK526557
Synonyms: 6-[butyl(ethyl)amino]-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: CCCCN(c1nc(c2ccccc2)c2c(c1C#N)CC(OC2)(C)C)CC

STK526561
Synonyms: 7-benzyl-1-(3,3-dimethylpiperidin-1-yl)-3-(morpholin-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: N#Cc1c2CCN(Cc2c(nc1N1CCOCC1)N1CCCC(C1)(C)C)Cc1ccccc1

STK526564
Synonyms: ({3-[(4-methylphenyl)carbonyl]-1-benzofuran-5-yl}oxy)aceticacid
Smiles: OC(=O)COc1ccc2c(c1)c(co2)C(=O)c1ccc(cc1)C

STK526565
Synonyms: 6-amino-4-(4-bromo-2-fluorophenyl)-3-methyl-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1F)Br)c(C)nn2c1ccccc1

STK526566
Synonyms: 3-(morpholin-4-yl)-1-[4-(pentyloxy)phenyl]-2-phenylpropan-1-ol
Smiles: CCCCCOc1ccc(cc1)C(C(c1ccccc1)CN1CCOCC1)O

STK526567
Synonyms: 6-[(4-bromobenzyl)sulfanyl]-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(SCc2ccc(cc2)Br)nc(c2c1CC(C)(C)OC2)N1CCOCC1

STK526568
Synonyms: 5-butyl-8-(propylsulfanyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCCC

STK526570
Synonyms: 3,3-dimethyl-8-(4-methylpiperazin-1-yl)-6-(methylsulfanyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: CSc1nc(N2CCN(CC2)C)c2c(c1C#N)CC(OC2)(C)C

STK526571
Synonyms: 2,2-dimethyl-5-(morpholin-4-yl)-N-(prop-2-en-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-8-amine
Smiles: C=CCNc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK526572
Synonyms: 5,5'-{[4-(benzyloxy)phenyl]methanediyl}dipyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(C(=O)N1)C(C1C(=O)NC(=O)NC1=O)c1ccc(cc1)OCc1ccccc1

STK526573
Synonyms: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(piperidin-1-yl)propan-1-one
Smiles: O=C(c1ccc2c(c1)OCCO2)CCN1CCCCC1

STK526575
Synonyms: N,N'-hexane-1,6-diylbis(4-propoxybenzenesulfonamide)
Smiles: CCCOc1ccc(cc1)S(=O)(=O)NCCCCCCNS(=O)(=O)c1ccc(cc1)OCCC

STK526576
Synonyms: N,N'-(sulfanediyldibenzene-4,1-diyl)bis(4-chlorobenzamide)
Smiles: O=C(c1ccc(cc1)Cl)Nc1ccc(cc1)Sc1ccc(cc1)NC(=O)c1ccc(cc1)Cl

STK526577
Synonyms: 4,4'-selanylbis[3-(2-methylpropyl)-1H-pyrazole]
Smiles: CC(Cc1n[nH]cc1[Se]c1c[nH]nc1CC(C)C)C

STK526578
Synonyms: 3,4,7,8,9,10-hexahydro-2H,6H-[1]benzothieno[2',3':4,5]pyrimido[2,1-b][1,3]thiazin-6-one
Smiles: O=c1c2c(sc3c2CCCC3)nc2n1CCCS2

STK526579
Synonyms: 6,6-dimethyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(=C)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK526582
Synonyms: 6-[(3-hydroxypropyl)amino]-3,3,8-trimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: OCCCNc1nc(C)c2c(c1C#N)CC(OC2)(C)C

STK526583
Synonyms: 2,2,2-trifluoro-1-(pentafluorophenyl)-1-(quinolin-6-yl)ethanol
Smiles: Fc1c(F)c(F)c(c(c1C(C(F)(F)F)(c1ccc2c(c1)cccn2)O)F)F

STK526584
Synonyms: N-(2-{(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide(non-preferredname)
Smiles: O=C(N/N=C(/c1ccco1)\C)CNC(=O)C1COc2c(O1)cccc2

STK526586
Synonyms: 3-phenyl-2-thioxo-2,3,6,7,8,9-hexahydropyrimido[4,5-b]quinolin-4(1H)-one
Smiles: S=c1[nH]c2nc3CCCCc3cc2c(=O)n1c1ccccc1

STK526587
Synonyms: 3-(3-chlorophenyl)-1-[3-(3-chlorophenyl)-1-(2-methoxybenzyl)-5,5-dimethyl-2-oxoimidazolidin-4-yl]-1-hydroxyurea
Smiles: COc1ccccc1CN1C(=O)N(C(C1(C)C)N(C(=O)Nc1cccc(c1)Cl)O)c1cccc(c1)Cl

STK526590
Synonyms: methyl(2Z)-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-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/c1cn(nc1c1ccccc1)c1ccccc1)/s2

STK526593
Synonyms: ethyl6-amino-2-({[4-(4-chlorophenyl)-3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-5-cyano-4-(thiophen-2-yl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CSc2nc(cc(c2C#N)c2ccc(cc2)Cl)c2cccs2)OC(=C(C1c1cccs1)C#N)N

STK526594
Synonyms: 6-amino-4-(naphthalen-1-yl)-1-phenyl-3-(trifluoromethyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc3c1cccc3)c(nn2c1ccccc1)C(F)(F)F

STK526596
Synonyms: 4-(4-chlorophenyl)-7,7-dimethyl-5-oxo-2-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)c2cc3ccccc3oc2=O)nc2c(c1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C

STK526597
Synonyms: 4-(3-methylphenyl)-1-(propan-2-ylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: CC(Sc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1cccc(c1)C)CCCCC3)C

STK526598
Synonyms: 5-bromo-N-[3-cyano-1-(4-methoxyphenyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl]furan-2-carboxamide
Smiles: COc1ccc(cc1)n1c2nc3ccccc3nc2c(c1NC(=O)c1ccc(o1)Br)C#N

STK526601
Synonyms: 1-benzyl-2-methyl-8-phenyl-1,5,6,7-tetrahydrocyclopenta[b]pyrrolo[2,3-e]pyridine-3-carbonitrile
Smiles: N#Cc1c2nc3CCCc3c(c2n(c1C)Cc1ccccc1)c1ccccc1

STK526602
Synonyms: 1-[(3-methylbutyl)sulfanyl]-4-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCCC3)C

STK526603
Synonyms: 1-[3-amino-6-tert-butyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl]-2,2-dimethylpropan-1-one
Smiles: Nc1c2c(sc1C(=O)C(C)(C)C)nc1c(c2c2cccs2)CC(CC1)C(C)(C)C

STK526604
Synonyms: ethyl[5-(N-tert-butylglycyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate
Smiles: CCOC(=O)Nc1ccc2c(c1)N(C(=O)CNC(C)(C)C)c1ccccc1CC2

STK526605
Synonyms: dimethylhydroxy[(phenylcarbonyl)amino]propanedioate
Smiles: COC(=O)C(C(=O)OC)(NC(=O)c1ccccc1)O

STK526606
Synonyms: N-hexyl-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-8-amine
Smiles: CCCCCCNc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK526608
Synonyms: ethyl{[4-(4-methoxyphenyl)-5-oxo-4,5,7,8,9,10-hexahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CCCCC3

STK526614
Synonyms: 2,3-dimethoxy-6-[(E)-{2-[({N-[(4-nitrophenyl)carbonyl]glycyl}amino)acetyl]hydrazinylidene}methyl]benzoicacid
Smiles: COc1ccc(c(c1OC)C(=O)O)/C=N/NC(=O)CNC(=O)CNC(=O)c1ccc(cc1)[N+](=O)[O-]

STK526615
Synonyms: 3-benzyl-2-(prop-2-yn-1-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: C#CCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK526616
Synonyms: 5-octadecyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCCCCCCCCCCCCCCCCCC1C(=O)NC(=S)NC1=O

STK526617
Synonyms: 8-tert-butyl-1-methyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: O=c1c2c3CCC(Cc3sc2n2c(n1c1ccccc1)nnc2C)C(C)(C)C

STK526618
Synonyms: (2E)-1-(4-bromophenyl)-3-(9-methyl-9H-carbazol-3-yl)prop-2-en-1-one
Smiles: Brc1ccc(cc1)C(=O)/C=C/c1ccc2c(c1)c1ccccc1n2C

STK526619
Synonyms: 4-hydroxy-2,2,6,6-tetramethylpiperidine-4-carbonitrile
Smiles: N#CC1(O)CC(C)(C)NC(C1)(C)C

STK526621
Synonyms: (8S,8aS)-6-amino-2-benzyl-8-(2-chloro-6-fluorophenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@H]([C@H]2C1=CCN(C2)Cc1ccccc1)c1c(F)cccc1Cl)(C#N)C#N

STK526622
Synonyms: 6-{[2-(dimethylamino)ethyl]amino}-8-ethyl-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(NCCN(C)C)nc(c2c1CC(C)(C)OC2)CC

STK526623
Synonyms: ethyl{[3-(4-methoxyphenyl)-8,8-dimethyl-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)OC

STK526624
Synonyms: 4-propoxybenzylcarbamimidothioate
Smiles: CCCOc1ccc(cc1)CSC(=N)N

STK526626
Synonyms: 8-butoxy-2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCOc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC(C)C

STK526627
Synonyms: ethyl4-(4-bromophenyl)-2-{[(2E)-2-cyano-3-(5-methylfuran-2-yl)prop-2-enoyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)/C(=C/c1ccc(o1)C)/C#N

STK526628
Synonyms: (2E)-2-[5-bromo-1-(2-chloroethyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]hydrazinecarbothioamide
Smiles: ClCCN1C(=O)/C(=N/NC(=S)N)/c2c1ccc(c2)Br

STK526629
Synonyms: 4-benzyl-1-(propylsulfanyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CCC3

STK526633
Synonyms: 4-oxo-4-(thiophen-2-yl)butanoicacid
Smiles: OC(=O)CCC(=O)c1cccs1

STK526636
Synonyms: N-ethyl-N-[(3-methylnaphthalen-2-yl)methyl]ethanamine
Smiles: CCN(Cc1cc2ccccc2cc1C)CC

STK526638
Synonyms: 4-butyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCn1c2nnc(n2c2c(c1=O)c1CCCCCc1s2)SCC(=O)c1ccccc1

STK526641
Synonyms: (6aS,8S,9R)-8-(2,4-diethoxyphenyl)-9-(phenylcarbonyl)-8,9-dihydropyrrolo[1,2-a][1,5]naphthyridine-7,7(6aH)-dicarbonitrile
Smiles: CCOc1cc(OCC)ccc1[C@H]1[C@H](C(=O)c2ccccc2)N2[C@H](C1(C#N)C#N)C=Cc1c2cccn1

STK526642
Synonyms: 4,4',4'',4'''-porphyrin-5,10,15,20-tetrayltetraaniline
Smiles: Nc1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/C3=N/C(=C(\c4[nH]c1cc4)/c1ccc(cc1)N)/C=C3)\c1ccc(cc1)N)/[nH]2)/c1ccc(cc1)N

STK526643
Synonyms: 4-[5-cyano-8-(furan-2-yl)-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridin-6-yl]-N-phenylpiperazine-1-carbothioamide
Smiles: N#Cc1c(nc(c2c1CC(C)(C)SC2)c1ccco1)N1CCN(CC1)C(=S)Nc1ccccc1

STK526644
Synonyms: 4,4'-[(6-methoxy-1,3,5-triazine-2,4-diyl)bis(oxy)]bis(N-phenylbenzamide)
Smiles: COc1nc(Oc2ccc(cc2)C(=O)Nc2ccccc2)nc(n1)Oc1ccc(cc1)C(=O)Nc1ccccc1

STK526645
Synonyms: 5-benzyl-2,6-diiodopyridin-3-ol
Smiles: Ic1nc(I)c(cc1Cc1ccccc1)O

STK526647
Synonyms: 1,3-bis(3,4-dichlorobenzyl)-5-fluoropyrimidine-2,4(1H,3H)-dione
Smiles: Clc1ccc(cc1Cl)Cn1cc(F)c(=O)n(c1=O)Cc1ccc(c(c1)Cl)Cl

STK526651
Synonyms: 2,5-di-tert-butyl-3-hydroxy-6-methoxycyclohexa-2,5-diene-1,4-dione
Smiles: COC1=C(C(=O)C(=C(C1=O)C(C)(C)C)O)C(C)(C)C

STK526656
Synonyms: ethyl(2Z)-2-[2-(4-nitrophenyl)hydrazinylidene]-3-phenylpropanoate
Smiles: CCOC(=O)/C(=N\Nc1ccc(cc1)[N+](=O)[O-])/Cc1ccccc1

STK526658
Synonyms: 2-phenoxyethyl2-aminobenzoate
Smiles: O=C(c1ccccc1N)OCCOc1ccccc1

STK526659
Synonyms: 7-benzyl-3-(morpholin-4-yl)-1-(prop-2-en-1-ylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: C=CCNc1nc(N2CCOCC2)c(c2c1CN(CC2)Cc1ccccc1)C#N

STK526660
Synonyms: 3-(3-chlorophenyl)-1-{3-(3-chlorophenyl)-1-[2-(2-methoxyphenyl)ethyl]-5,5-dimethyl-2-oxoimidazolidin-4-yl}-1-hydroxyurea
Smiles: COc1ccccc1CCN1C(=O)N(C(C1(C)C)N(C(=O)Nc1cccc(c1)Cl)O)c1cccc(c1)Cl

STK526661
Synonyms: 3-[4-(propan-2-yloxy)phenyl]-N'-[(E)-pyridin-4-ylmethylidene]propanehydrazide
Smiles: O=C(CCc1ccc(cc1)OC(C)C)N/N=C/c1ccncc1

STK526663
Synonyms: 3-cyano-6-oxo-5-[4-(pyridin-4-yl)pyridinium-1-yl]-4-[2-(trifluoromethyl)phenyl]-1,4,5,6-tetrahydropyridin-2-olate
Smiles: N#CC1=C([O-])NC(=O)C(C1c1ccccc1C(F)(F)F)[n+]1ccc(cc1)c1ccncc1

STK526665
Synonyms: 1-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]phthalazine
Smiles: COc1ccc(cc1)/C=N/Nc1nncc2c1cccc2

STK526667
Synonyms: 7-ethyl-1-[(2-hydroxyethyl)amino]-3-(piperidin-1-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: OCCNc1nc(N2CCCCC2)c(c2c1CN(CC)CC2)C#N

STK526669
Synonyms: 2-amino-4-(5-bromothiophen-2-yl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(s1)Br)c(=O)oc1c2cccc1

STK526671
Synonyms: (2Z)-5-amino-3-oxo-2-[2-(trifluoromethyl)benzylidene]-7-[3-(trifluoromethyl)phenyl]-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Smiles: N#CC1=c2s/c(=C\c3ccccc3C(F)(F)F)/c(=O)n2C(=C(C1c1cccc(c1)C(F)(F)F)C#N)N

STK526672
Synonyms: N'-(3,6,6-trimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)propanehydrazide
Smiles: CCC(=O)NNc1nc2sc3c(c2c(=O)n1C)CC(OC3)(C)C

STK526673
Synonyms: 6,6-dimethyl-2-(methylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Smiles: CSc1nc(N)c2c(n1)sc1c2CC(OC1)(C)C

STK526674
Synonyms: 2-[(5E)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-3-methylbutanoicacid
Smiles: CC(C(N1C(=S)S/C(=C/c2ccc(o2)c2ccc(cc2)Br)/C1=O)C(=O)O)C

STK526675
Synonyms: 2,6-bis[4-(dimethylamino)phenyl]-3,5-dimethylpiperidin-4-one
Smiles: CC1C(=O)C(C)C(NC1c1ccc(cc1)N(C)C)c1ccc(cc1)N(C)C

STK526676
Synonyms: 2-(1H-benzimidazol-2-yl)-3-[2-(difluoromethoxy)phenyl]propanenitrile
Smiles: N#CC(c1nc2c([nH]1)cccc2)Cc1ccccc1OC(F)F

STK526677
Synonyms: ethyl2,4,5,6-tetrachloropyridine-3-carboxylate
Smiles: CCOC(=O)c1c(Cl)nc(c(c1Cl)Cl)Cl

STK526678
Synonyms: [(2-methylquinolin-4-yl)oxy]aceticacid
Smiles: OC(=O)COc1cc(C)nc2c1cccc2

STK526679
Synonyms: 1-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCCC3

STK526680
Synonyms: 2,4-dibromo-6-{(E)-[(4,5-diphenyl-1-{[(E)-phenylmethylidene]amino}-1H-imidazol-2-yl)imino]methyl}phenol
Smiles: Brc1cc(/C=N/c2nc(c(n2/N=C/c2ccccc2)c2ccccc2)c2ccccc2)c(c(c1)Br)O

STK526681
Synonyms: N-[2-(triphenyl-lambda~5~-phosphanylidene)acetyl]benzamide
Smiles: O=C(C=P(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)c1ccccc1

STK526683
Synonyms: 1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-(4-methylphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: Cc1ccc(cc1)n1c2nnc(n2c2c(c1=O)C1(CCCCC1)Cc1c2cccc1)SCC(=O)c1ccc(cc1)Cl

STK526684
Synonyms: (2Z)-2,3,4,5,5-pentachloropenta-2,4-dienoicacid
Smiles: ClC(=C(/C(=C(\C(=O)O)/Cl)/Cl)Cl)Cl

STK526685
Synonyms: N-(2-{(2E)-2-[2-(benzyloxy)-5-bromobenzylidene]hydrazinyl}-2-oxoethyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccc2c(c1)OCCO2)N/N=C/c1cc(Br)ccc1OCc1ccccc1

STK526686
Synonyms: N-{(2E)-3-(3-nitrophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}valine
Smiles: CC(C(C(=O)O)NC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1)C

STK526687
Synonyms: 3-(4-chlorophenyl)-1-[3-(4-chlorophenyl)-5,5-dimethyl-1-{5-[(2Z)-2-(3-nitrobenzylidene)hydrazinyl]-5-oxopentyl}-2-oxoimidazolidin-4-yl]-1-hydroxyurea
Smiles: O=C(N/N=C\c1cccc(c1)[N+](=O)[O-])CCCCN1C(=O)N(C(C1(C)C)N(C(=O)Nc1ccc(cc1)Cl)O)c1ccc(cc1)Cl

STK526688
Synonyms: 1-(4-iodophenyl)-9-phenyl-5,6,7,8-tetrahydro-1H-imidazo[4,5-b]quinoline
Smiles: Ic1ccc(cc1)n1cnc2c1c(c1ccccc1)c1c(n2)CCCC1

STK526689
Synonyms: 4-benzyl-1-[(2-methylprop-2-en-1-yl)sulfanyl]-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: CC(=C)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2Cc1ccccc1)CCCCC3

STK526690
Synonyms: N'-[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-8-yl]-N,N-diethylethane-1,2-diamine
Smiles: CCN(CCNc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1)CC

STK526691
Synonyms: (1S,2S,3aR)-2-(4-methoxyphenyl)-1-(phenylcarbonyl)-1,2-dihydrobenzo[h]pyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@H](c2ccc(cc2)OC)[C@H](N2[C@@H]1C=Cc1c2c2ccccc2cc1)C(=O)c1ccccc1

STK526692
Synonyms: 1,7-dibenzyl-8-[(2-hydroxyethyl)amino]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCNc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1

STK526693
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-(4-fluorophenyl)-6-phenylpyridine-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)Cl)nc(cc1c1ccc(cc1)F)c1ccccc1

STK526694
Synonyms: diethyl[(1E)-2-amino-N-{[(2-chloro-4-nitrophenyl)carbonyl]oxy}-2-oxoethanimidoyl]phosphonate
Smiles: CCOP(=O)(/C(=N/OC(=O)c1ccc(cc1Cl)[N+](=O)[O-])/C(=O)N)OCC

STK526695
Synonyms: trifluoromethyl(8S,8aR)-6-amino-8-(3-chlorophenyl)-5,7,7-tricyano-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(=O)OC(F)(F)F)c1cccc(c1)Cl)(C#N)C#N

STK526697
Synonyms: 3,3'-piperazine-1,4-diylbis(5,5-dimethyl-2-nitrocyclohex-2-en-1-one)
Smiles: [O-][N+](=O)C1=C(CC(CC1=O)(C)C)N1CCN(CC1)C1=C([N+](=O)[O-])C(=O)CC(C1)(C)C

STK526698
Synonyms: 2-[2-(9H-carbazol-9-yl)ethoxy]ethanol
Smiles: OCCOCCn1c2ccccc2c2c1cccc2

STK526700
Synonyms: (3-amino-6-butylthieno[2,3-b]pyridin-2-yl)(4-bromophenyl)methanone
Smiles: CCCCc1ccc2c(n1)sc(c2N)C(=O)c1ccc(cc1)Br

STK526702
Synonyms: N-(4-methoxybenzyl)-1,2,5-trimethylpiperidin-4-amine
Smiles: COc1ccc(cc1)CNC1CC(C)N(CC1C)C

STK526704
Synonyms: 4-methyl-7-(naphthalen-1-ylmethoxy)-2H-chromen-2-one
Smiles: O=c1cc(C)c2c(o1)cc(cc2)OCc1cccc2c1cccc2

STK526705
Synonyms: 3-(2-thioxo-1,3-benzoxazol-3(2H)-yl)propanoicacid
Smiles: OC(=O)CCn1c(=S)oc2c1cccc2

STK526706
Synonyms: (5Z)-5-{3-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-4-methoxybenzylidene}-1-(2-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1F

STK526707
Synonyms: 6-{[2-(dimethylamino)ethyl]amino}-3,3-dimethyl-8-phenyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(NCCN(C)C)nc(c2c1CC(C)(C)OC2)c1ccccc1

STK526709
Synonyms: (2E)-2-(4-propoxybenzylidene)hydrazinecarbothioamide
Smiles: CCCOc1ccc(cc1)/C=N/NC(=S)N

STK526710
Synonyms: diethyl[(1E)-2-amino-N-{[(2-bromophenyl)carbonyl]oxy}-2-oxoethanimidoyl]phosphonate
Smiles: CCOP(=O)(/C(=N/OC(=O)c1ccccc1Br)/C(=O)N)OCC

STK526712
Synonyms: tert-butyl(8R)-6-amino-8-(4-bromophenyl)-5,7,7-tricyano-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: N#CC1=C(N)C([C@H](C2C1=CCN(C2)C(=O)OC(C)(C)C)c1ccc(cc1)Br)(C#N)C#N

STK526716
Synonyms: 2-(benzylsulfanyl)-6,6-dimethyl-3-(2-methylpropyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(Cn1c(SCc2ccccc2)nc2c(c1=O)c1CC(C)(C)OCc1s2)C

STK526717
Synonyms: ethoxy(diphenyl)aceticacid
Smiles: CCOC(c1ccccc1)(c1ccccc1)C(=O)O

STK526720
Synonyms: 1-[4-(2-methylpropoxy)phenyl]-2-phenyl-3-(piperidin-1-yl)propan-1-ol
Smiles: CC(COc1ccc(cc1)C(C(c1ccccc1)CN1CCCCC1)O)C

STK526721
Synonyms: 2,2-dimethyl-5-propyl-2,3-dihydro-1H-pyrano[3'',2'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Smiles: CCCc1nc2sc3c(c2c2c1OCC(C2)(C)C)nc[nH]c3=O

STK526723
Synonyms: 6-(ethylsulfanyl)-2,3'-bipyridine-5-carbonitrile
Smiles: CCSc1nc(ccc1C#N)c1cccnc1

STK526724
Synonyms: 2-({5-[(2,4-dichlorophenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-1-[4-(methylsulfanyl)phenyl]ethanone
Smiles: CSc1ccc(cc1)C(=O)CSc1nnc(o1)COc1ccc(cc1Cl)Cl

STK526725
Synonyms: ethyl2-amino-4-[4-(benzyloxy)phenyl]-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccc(cc1)OCc1ccccc1)c(=O)oc(c2)C

STK526726
Synonyms: ethyl(8R,8aR)-6-amino-5,7,7-tricyano-8-(2,3-dimethoxyphenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1cccc(c1OC)OC)C(C(=C2C#N)N)(C#N)C#N

STK526727
Synonyms: 3,3-dimethyl-6-{[2-(morpholin-4-yl)ethyl]amino}-8-phenyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(NCCN2CCOCC2)nc(c2c1CC(C)(C)OC2)c1ccccc1

STK526728
Synonyms: ethyl2-{[(3-{[(4-methylphenyl)sulfonyl]amino}naphthalen-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc3ccccc3cc2NS(=O)(=O)c2ccc(cc2)C)sc2c1CCCC2

STK526729
Synonyms: 2-(4,5-dihydro-1,3-thiazol-2-ylamino)-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CNC1=NCCS1)c(n2C)C

STK526730
Synonyms: 6-amino-4-(3-iodophenyl)-3-methyl-1-phenyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)I)c(C)nn2c1ccccc1

STK526731
Synonyms: N-{(2E,4E)-1-[2-(4-nitrophenyl)hydrazinyl]-1-oxo-5-phenylpenta-2,4-dien-2-yl}benzamide
Smiles: O=C(/C(=C\C=C\c1ccccc1)/NC(=O)c1ccccc1)NNc1ccc(cc1)[N+](=O)[O-]

STK526732
Synonyms: 4-(4-methoxyphenyl)-1-(methylsulfanyl)-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccc(cc1)n1c(=O)c2c3CCCCCc3sc2n2c1nnc2SC

STK526735
Synonyms: 1-{3-[(diethylamino)methyl]-4-ethoxyphenyl}ethanone
Smiles: CCOc1ccc(cc1CN(CC)CC)C(=O)C

STK526736
Synonyms: 6-[2-(4-bromophenyl)-2-oxoethoxy]-8-butyl-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: CCCCc1nc(OCC(=O)c2ccc(cc2)Br)c(c2c1COC(C2)(C)C)C#N

STK526737
Synonyms: 1,8,8-trimethyl-3-(4-methylphenyl)-3-azabicyclo[3.2.1]octane-2,4-dione
Smiles: Cc1ccc(cc1)N1C(=O)C2CCC(C1=O)(C2(C)C)C

STK526738
Synonyms: ethyl(2Z)-2-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-5-(4-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1cn(nc1c1ccccc1)c1ccccc1)/s2

STK526739
Synonyms: 1-{3-[(2-amino-4,6-dihydroxypyrimidin-5-yl)methyl]-4-ethoxyphenyl}ethanone
Smiles: CCOc1ccc(cc1Cc1c(O)nc(nc1O)N)C(=O)C

STK526740
Synonyms: N-cyclohexyl-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: Cc1nc2sc3c(c2c2c1CCCC2)ncnc3NC1CCCCC1

STK526741
Synonyms: 5-{(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)[4-methoxy-3-(pyrrolidinium-1-ylmethyl)phenyl]methyl}-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-olate
Smiles: COc1ccc(cc1C[NH+]1CCCC1)C(c1c(O)[nH]c(=O)[nH]c1=O)c1c([O-])[nH]c(=O)[nH]c1=O

STK526742
Synonyms: benzyl3-amino-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)thieno[2,3-b]pyridine-2-carboxylate
Smiles: O=C(c1sc2c(c1N)ccc(n2)C12CC3CC(C2)CC(C1)C3)OCc1ccccc1

STK526744
Synonyms: (2Z)-1-(4-nitrophenyl)-2-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)ethanone
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])/C=C/1\N(C)c2c(C1(C)C)cccc2

STK526745
Synonyms: ethenyl{[3-cyano-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetate
Smiles: C=COC(=O)CSc1nc(cc(c1C#N)c1ccc(cc1)F)c1cccs1

STK526746
Synonyms: {4-[(4-chlorophenyl)amino]-6-(diethylamino)-1,3,5-triazin-2-yl}cyanamide
Smiles: N#CNc1nc(Nc2ccc(cc2)Cl)nc(n1)N(CC)CC

STK526747
Synonyms: 1-(3,5-dibromo-2-hydroxyphenyl)propan-1-one
Smiles: CCC(=O)c1cc(Br)cc(c1O)Br

STK526749
Synonyms: 1-(cyclohexylamino)-7-methyl-3-(morpholin-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: N#Cc1c(nc(c2c1CCN(C2)C)NC1CCCCC1)N1CCOCC1

STK526750
Synonyms: (3Z,5Z)-3-[(benzylamino)methylidene]-5-benzylidenepyrrolidine-2,4-dione
Smiles: O=C1N/C(=C\c2ccccc2)/C(=O)/C/1=C/NCc1ccccc1

STK526751
Synonyms: ethyl6-[(2-tert-butoxy-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=C(C1c1cccs1)C#N)SCC(=O)OC(C)(C)C

STK526755
Synonyms: 1-(pentylsulfanyl)-4-(2-phenylethyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: CCCCCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2CCc1ccccc1)CCCCC3

STK526758
Synonyms: methyl(2Z)-2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)Cl)c1ccccc1)/s2

STK526759
Synonyms: N'-[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-8-yl]-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1)C

STK526760
Synonyms: 1,3-dichloro-7-ethyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: CCN1CCc2c(C1)c(Cl)nc(c2C#N)Cl

STK526761
Synonyms: ethyl2-{[5-cyano-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}propanoate
Smiles: CCOC(=O)C(Sc1nc(N2CCOCC2)c2c(c1C#N)CC(OC2)(C)C)C

STK526762
Synonyms: dipropan-2-yl[(1Z)-2-amino-N-{[(3-iodophenyl)carbonyl]oxy}-2-oxoethanimidoyl]phosphonate
Smiles: CC(OP(=O)(/C(=N\OC(=O)c1cccc(c1)I)/C(=O)N)OC(C)C)C

STK526764
Synonyms: 5-chloro-N-{3-chloro-4-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-{[(4-chlorophenyl)sulfonyl]amino}benzamide
Smiles: Clc1ccc(c(c1)C(=O)Nc1ccc(c(c1)Cl)Oc1ccc2c(c1Cl)cccc2)NS(=O)(=O)c1ccc(cc1)Cl

STK526765
Synonyms: dimethylN',N'''-[(2-hydroxy-5-methylbenzene-1,3-diyl)di(E)methylylidene]biscarbamohydrazonothioate
Smiles: CS/C(=N/N=C/c1cc(C)cc(c1O)/C=N/N=C(/SC)\N)/N

STK526766
Synonyms: 4-(4-methylphenyl)-1-(propylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: CCCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccc(cc1)C)CCCCC3

STK526767
Synonyms: 4-(4-methoxyphenyl)-1-(prop-2-en-1-ylsulfanyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)OC)CCC3

STK526768
Synonyms: (2R,3R,10bS)-3-[(4-methoxyphenyl)carbonyl]-2-(thiophen-2-yl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2cccs2)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)c1ccc(cc1)OC

STK526770
Synonyms: ethyl{[6,6-dimethyl-3-(2-methylprop-2-en-1-yl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2sc3c(c2c(=O)n1CC(=C)C)CC(OC3)(C)C

STK526771
Synonyms: propyl{[5-cyano-3,3-dimethyl-8-(morpholin-4-yl)-3,4-dihydro-1H-pyrano[3,4-c]pyridin-6-yl]sulfanyl}acetate
Smiles: CCCOC(=O)CSc1nc(N2CCOCC2)c2c(c1C#N)CC(OC2)(C)C

STK526772
Synonyms: 2-amino-4-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCCC2)c1ccc(c(c1)Cn1ncc(c1)[N+](=O)[O-])OC)(C#N)C#N

STK526773
Synonyms: 2-(heptylsulfanyl)-6,6-dimethyl-3-(2-phenylethyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1CCc1ccccc1)CC(OC3)(C)C

STK526776
Synonyms: 5-butyl-8-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCc1nc2sc3c(c2c2c1CCCC2)ncnc3N1CCOCC1

STK526777
Synonyms: 6-amino-8-(3-bromo-4-fluorophenyl)-2-methyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)C)c1ccc(c(c1)Br)F)(C#N)C#N

STK526778
Synonyms: (4R,7S)-2-hydroxy-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Smiles: ON1C(=O)C2C(C1=O)[C@@H]1O[C@H]2C=C1

STK526779
Synonyms: N-(4-fluorobenzyl)-4-(9H-xanthen-9-yl)aniline
Smiles: Fc1ccc(cc1)CNc1ccc(cc1)C1c2ccccc2Oc2c1cccc2

STK526780
Synonyms: 4-benzyl-1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CCC3

STK526781
Synonyms: 8-(biphenyl-4-yloxy)-7-(4-bromobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)Cn1c(Oc2ccc(cc2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK526782
Synonyms: ethyl6-amino-5-cyano-4-(2-iodophenyl)-2-phenyl-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(OC(=C(C1c1ccccc1I)C#N)N)c1ccccc1

STK526783
Synonyms: 7-benzyl-3-chloro-1-(cyclohexylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: N#Cc1c(Cl)nc(c2c1CCN(C2)Cc1ccccc1)NC1CCCCC1

STK526784
Synonyms: 1-(azepan-1-yl)-3-(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)propan-2-ol
Smiles: OC(CN1CCn2c3C1CCCc3c1c2ccc(c1)C1CCCCC1)CN1CCCCCC1

STK526786
Synonyms: 2-[(3,5-di-tert-butyl-4-hydroxyphenyl)sulfanyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide
Smiles: O=C(CSc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)NCCc1c[nH]c2c1cccc2

STK526789
Synonyms: 4-(4-methylphenyl)-1-(propan-2-ylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: CC(Sc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccc(cc1)C)CCCCC3)C

STK526790
Synonyms: 2-[(4-fluorobenzyl)sulfanyl]-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Fc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)C

STK526791
Synonyms: [3-amino-4-(4-methoxyphenyl)-6-phenylthieno[2,3-b]pyridin-2-yl](biphenyl-4-yl)methanone
Smiles: COc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)c1ccc(cc1)c1ccccc1)c1ccccc1

STK526794
Synonyms: N'-[(2-bromo-1-methylcyclopropyl)carbonyl]-3-nitrobenzohydrazide
Smiles: BrC1CC1(C)C(=O)NNC(=O)c1cccc(c1)[N+](=O)[O-]

STK526796
Synonyms: 3-(3,5-di-tert-butyl-4-hydroxybenzyl)pentane-2,4-dione
Smiles: CC(=O)C(C(=O)C)Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C

STK526798
Synonyms: ethyl6-ethyl-2-[(phenylcarbamothioyl)amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)Nc2ccccc2)sc2c1CCN(C2)CC

STK526799
Synonyms: 2-[2-benzyl-4-hydroxy-5-(3-methylbutoxy)pentanoyl]-N-phenylhydrazinecarbothioamide(non-preferredname)
Smiles: OC(CC(C(=O)NNC(=S)Nc1ccccc1)Cc1ccccc1)COCCC(C)C

STK526800
Synonyms: methyl6-{(5E)-5-[3-(6-methoxy-6-oxohexyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}hexanoate
Smiles: COC(=O)CCCCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCCCC(=O)OC)/C1=O

STK526801
Synonyms: (2R,3R,10bS)-3-[(4-ethylphenyl)carbonyl]-2-phenyl-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Smiles: N#CC1(C#N)[C@@H](c2ccccc2)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)c1ccc(cc1)CC

STK526802
Synonyms: 1-amino-5-methyl-N-[3-(trifluoromethyl)phenyl]-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)C)Nc1cccc(c1)C(F)(F)F

STK526804
Synonyms: 3',6'-bis(diethylamino)-2-(2-methylphenyl)spiro[isoindole-1,9'-xanthen]-3(2H)-one
Smiles: CCN(c1ccc2c(c1)Oc1c(C32c2ccccc2C(=O)N3c2ccccc2C)ccc(c1)N(CC)CC)CC

STK526805
Synonyms: 4-(4-fluorophenyl)-2-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}-6-phenylpyridine-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)C23CC4CC(C3)CC(C2)C4)nc(cc1c1ccc(cc1)F)c1ccccc1

STK526806
Synonyms: (3Z)-5-bromo-3-[(2E)-2,3,4,9-tetrahydro-1H-carbazol-1-ylidenehydrazinylidene]-1,3-dihydro-2H-indol-2-one
Smiles: Brc1ccc2c(c1)/C(=N/N=C/1\CCCc3c1[nH]c1c3cccc1)/C(=O)N2

STK526807
Synonyms: 2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3H-benzo[f]chromen-3-imine
Smiles: Clc1ccc(cc1)c1csc(n1)c1cc2c(oc1=N)ccc1c2cccc1

STK526808
Synonyms: 2-(butylsulfanyl)pyrimidinediium-4,6-diolate
Smiles: CCCCSc1[nH+]c([O-])cc([nH+]1)[O-]

STK526809
Synonyms: {4-[2-hydroxy-3-(3-methylphenoxy)propyl]piperazin-1-yl}(4-methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)N1CCN(CC1)CC(COc1cccc(c1)C)O

STK526810
Synonyms: ethyl2-{[(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)acetyl]amino}-4,5-dimethylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCn3c4C2CCCc4c2c3ccc(c2)C2CCCCC2)sc(c1C)C

STK526813
Synonyms: 2-(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-phenylhydrazinecarbothioamide
Smiles: S=C(Nc1ccccc1)NNc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3

STK526814
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)C1(CCCC1)Cc1c2cccc1

STK526815
Synonyms: 2-{[3-cyano-4-(2-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: N#Cc1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nc(cc1c1ccccc1OC)c1ccccc1

STK526817
Synonyms: 6-[2-(4-chlorophenyl)-2-oxoethoxy]-8-ethyl-3,3-dimethyl-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(OCC(=O)c2ccc(cc2)Cl)nc(c2c1CC(C)(C)OC2)CC

STK526819
Synonyms: N~3~-benzyl-N~3~-methyl-beta-alaninamide
Smiles: CN(Cc1ccccc1)CCC(=O)N

STK526820
Synonyms: 3-(2-chloroethyl)-1-methyl-6,7-dihydro[1,3]thiazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: ClCCn1c(=O)n(C)c2c(c1=O)n1CCSc1n2

STK526821
Synonyms: 6,8-dibromo-2-imino-N-(2-methoxyphenyl)-2H-chromene-3-carboxamide
Smiles: COc1ccccc1NC(=O)c1cc2cc(Br)cc(c2oc1=N)Br

STK526822
Synonyms: 2-(4-amino-3,5-dibromophenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Smiles: O=C1C2CC=CCC2C(=O)N1c1cc(Br)c(c(c1)Br)N

STK526823
Synonyms: 2-(3-methylphenoxy)-2,4,4,6,6,8,8-heptakis(4-methylphenoxy)-1,3,5,7,2lambda~5~,4lambda~5~,6lambda~5~,8lambda~5~-tetrazatetraphosphocine
Smiles: Cc1ccc(cc1)OP1(=NP(=NP(=NP(=N1)(Oc1ccc(cc1)C)Oc1ccc(cc1)C)(Oc1ccc(cc1)C)Oc1cccc(c1)C)(Oc1ccc(cc1)C)Oc1ccc(cc1)C)Oc1ccc(cc1)C

STK526825
Synonyms: N-[(1E)-1-(3,4-dimethoxyphenyl)-3-{(2E)-2-[(3E)-4-(furan-2-yl)but-3-en-2-ylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
Smiles: COc1cc(ccc1OC)/C=C(\C(=O)N/N=C(/C=C/c1ccco1)\C)/NC(=O)c1ccccc1

STK526826
Synonyms: ethyl3-{[(4-cyclohexylpiperazin-1-yl)acetyl]amino}-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)cc(cc2)OC

STK526827
Synonyms: methyl3-({[4-(2-fluorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1F)cccc2

STK526829
Synonyms: (2E)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-3-{[2-(propan-2-yl)phenyl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1C(C)C)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

STK526830
Synonyms: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-3-(piperidin-1-ylcarbonyl)quinolin-4(1H)-one
Smiles: CCn1cc(C(=O)N2CCCCC2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK526832
Synonyms: 5,5'-[ethane-1,2-diylbis(imino-1,3-thiazole-2,4-diyl)]bis(3-butyl-5-methyldihydrofuran-2(3H)-one)
Smiles: CCCCC1CC(OC1=O)(C)c1csc(n1)NCCNc1scc(n1)C1(C)CC(C(=O)O1)CCCC

STK526834
Synonyms: ethyl5-methoxy-3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCSCC1)cc(cc2)OC

STK526835
Synonyms: 4-(4-fluorophenyl)piperazine-1-carbothioamide
Smiles: NC(=S)N1CCN(CC1)c1ccc(cc1)F

STK526836
Synonyms: dimethyl{[(4-methylphenyl)amino](phenyl)methyl}phosphonate
Smiles: COP(=O)(C(c1ccccc1)Nc1ccc(cc1)C)OC

STK526839
Synonyms: ethyl(2E)-2-(2,4-dichlorobenzylidene)-7-methyl-5-(3-nitrophenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1)[N+](=O)[O-])c(=O)/c(=C\c1ccc(cc1Cl)Cl)/s2

STK526840
Synonyms: methyl5-chloro-3-({[4-(ethoxycarbonyl)piperidin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC

STK526841
Synonyms: ethyl4-(2,4-dimethoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(C)N(C)C(=O)NC1c1ccc(cc1OC)OC

STK526843
Synonyms: 8-bromo-3-{[(E)-(3-chlorophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)Cl

STK526844
Synonyms: (2E)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[(4-methylphenyl)amino]prop-2-enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)C)/C#N

STK526845
Synonyms: (3aS,7aR)-1-methoxy-3a,4,5,6,7,7a-hexahydro-1H-benzotriazole2-oxide
Smiles: CON1[N+](=N[C@@H]2[C@H]1CCCC2)[O-]

STK526846
Synonyms: diethyl{[(4-bromophenyl)amino](4-methoxyphenyl)methyl}phosphonate
Smiles: CCOP(=O)(C(c1ccc(cc1)OC)Nc1ccc(cc1)Br)OCC

STK526847
Synonyms: 2,3,4-tribromo-6-methoxyaniline
Smiles: COc1cc(Br)c(c(c1N)Br)Br

STK526848
Synonyms: 2-(4-chlorophenyl)-4-{(2E)-2-[1-(3,4-dimethoxyphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: COc1cc(ccc1OC)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl)/C

STK526849
Synonyms: 7-(4-nitrophenyl)-7H-[1,2,3]triazolo[4,5-e][2,1,3]benzoxadiazole3-oxide
Smiles: [O-][N+](=O)c1ccc(cc1)n1nc2c(n1)c1no[n+](c1cc2)[O-]

STK526850
Synonyms: (3S,4S)-3,4-bis(butylsulfanyl)tetrahydrothiophene1,1-dioxide
Smiles: CCCCS[C@H]1CS(=O)(=O)C[C@@H]1SCCCC

STK526852
Synonyms: 3-{[(E)-(2-chlorophenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccc1Cl

STK526853
Synonyms: N-(4-phenyl-1,3-thiazol-2-yl)-N'-(pyridin-2-ylmethyl)ethanediamide
Smiles: O=C(C(=O)Nc1scc(n1)c1ccccc1)NCc1ccccn1

STK526854
Synonyms: ethyl5-methoxy-3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1OC)cc(cc2)OC

STK526855
Synonyms: 2-ethyl-N-[(1Z)-4,4,7-trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]aniline
Smiles: CCc1ccccc1/N=c/1\ssc2c1c1ccc(cc1NC2(C)C)C

STK526856
Synonyms: (2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(3-bromophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)Br)/c1scc(n1)c1ccc2c(c1)OCO2

STK526858
Synonyms: N-[(E)-(4-bromophenyl)methylidene]-9H-carbazol-3-amine
Smiles: Brc1ccc(cc1)/C=N/c1ccc2c(c1)c1ccccc1[nH]2

STK526860
Synonyms: methyl3-{[(2-ethylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: CCC1CCCCN1CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK526861
Synonyms: 1-[3-(2,6-dimethoxyphenoxy)-2-methylpropyl]-4-methylpiperazine
Smiles: COc1cccc(c1OCC(CN1CCN(CC1)C)C)OC

STK526862
Synonyms: N,N'-bis(4-bromophenyl)-2-(2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-ylidene)propanediamide
Smiles: Brc1ccc(cc1)NC(=O)/C(=C\1/NC2(CCCCC2)Cc2c1cccc2)/C(=O)Nc1ccc(cc1)Br

STK526863
Synonyms: 6-chloro-3-(hydroxymethyl)-1,3-benzoxazol-2(3H)-one
Smiles: OCn1c(=O)oc2c1ccc(c2)Cl

STK526864
Synonyms: 5-acetyl-4-(4-butoxyphenyl)-6-methyl-2-(prop-2-en-1-ylsulfanyl)-1,4-dihydropyridine-3-carbonitrile
Smiles: CCCCOc1ccc(cc1)C1C(=C(C)NC(=C1C#N)SCC=C)C(=O)C

STK526867
Synonyms: 6-bromo-2-[(2E)-2-(1H-indol-3-ylmethylidene)hydrazinyl]-4-phenylquinoline
Smiles: Brc1ccc2c(c1)c(cc(n2)N/N=C/c1c[nH]c2c1cccc2)c1ccccc1

STK526868
Synonyms: furan-2-yl{4-[2-(naphthalen-1-yloxy)ethyl]piperazin-1-yl}methanone
Smiles: O=C(c1ccco1)N1CCN(CC1)CCOc1cccc2c1cccc2

STK526870
Synonyms: methyl5-bromo-3-({[4-(4-chlorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cc(cc2)Br

STK526872
Synonyms: (2E)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-{[2-(propan-2-yl)phenyl]amino}prop-2-enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccccc1C(C)C)/C#N

STK526877
Synonyms: 2-[2-(3,4-dichlorophenyl)-9H-imidazo[1,2-a]benzimidazol-9-yl]-N,N-diethylethanamine
Smiles: CCN(CCn1c2nc(cn2c2c1cccc2)c1ccc(c(c1)Cl)Cl)CC

STK526878
Synonyms: 1,1'-(disulfanediyldiethane-2,1-diyl)bis(3-naphthalen-1-ylurea)
Smiles: O=C(Nc1cccc2c1cccc2)NCCSSCCNC(=O)Nc1cccc2c1cccc2

STK526879
Synonyms: 6-amino-4-(5-nitrothiophen-2-yl)-3-propyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCc1n[nH]c2c1C(c1ccc(s1)[N+](=O)[O-])C(=C(O2)N)C#N

STK526881
Synonyms: 4-{(2E)-2-[1-(4-bromophenyl)ethylidene]hydrazinyl}-2-(4-chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C(/c2ccc(cc2)Br)\C)c2c(n1)cccc2

STK526882
Synonyms: 4-[bis(5-methylfuran-2-yl)methyl]-N-[(E)-(3-nitrophenyl)methylidene]aniline
Smiles: Cc1ccc(o1)C(c1ccc(o1)C)c1ccc(cc1)/N=C/c1cccc(c1)[N+](=O)[O-]

STK526883
Synonyms: N,N'-(hexane-1,6-diylbis{imino[(1E)-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-ene-3,2-diyl]})dibenzamide
Smiles: O=C(/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)NCCCCCCNC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1

STK526886
Synonyms: ethylN-[(2-ethoxyphenyl)carbonyl]-3,3,3-trifluoro-2-(pyridin-2-ylamino)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1OCC)Nc1ccccn1

STK526887
Synonyms: 8-bromo-7-[2-hydroxy-3-(4-iodophenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(Br)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)I

STK526888
Synonyms: 3-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(ccc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK526890
Synonyms: 3-imino-5-(4-methoxyphenyl)-1-methyl-7-phenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1ccc(cc1)OC)(C(C2(C#N)C#N)c1ccccc1)C

STK526892
Synonyms: 3-(2,6-dimethoxyphenoxy)-N-(furan-2-ylmethyl)-2-methylpropan-1-amine
Smiles: COc1cccc(c1OCC(CNCc1ccco1)C)OC

STK526893
Synonyms: 7-heptyl-8-[(2-hydroxypropyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(SCC(O)C)nc2c1c(=O)[nH]c(=O)n2C

STK526894
Synonyms: ethyl3-({[4-(2-fluorophenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1F)cc(cc2)OC

STK526898
Synonyms: 3-methyl-7-nonyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCSc1nc2c(n1CCCCCCCCC)c(=O)[nH]c(=O)n2C

STK526899
Synonyms: 4-[(2E)-2-(2,4-dichlorobenzylidene)hydrazinyl]-2-(3,4-dichlorophenyl)quinazoline
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK526900
Synonyms: 2-(2-chlorophenyl)-4-[(2E)-2-(2,4-dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(OC)ccc1/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK526901
Synonyms: 4-{(2E)-2-[1-(pyridin-3-yl)ethylidene]hydrazinyl}[1,2,4]triazolo[4,3-a]quinoxaline
Smiles: C/C(=N\Nc1nc2ccccc2n2c1nnc2)/c1cccnc1

STK526902
Synonyms: 4-({(E)-2-cyano-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzenesulfonamide
Smiles: CCc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)S(=O)(=O)N)/C#N

STK526903
Synonyms: ethyl4-(nonylamino)-2-oxo-1,2-dihydroquinoline-3-carboxylate
Smiles: CCCCCCCCCNc1c2ccccc2[nH]c(=O)c1C(=O)OCC

STK526905
Synonyms: (2E)-3-[(3-chloro-4-methylphenyl)amino]-2-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1ccc(c(c1)Cl)Cl

STK526907
Synonyms: 8-{(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-7-heptyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(N/N=C(/c2ccc(cc2)Cl)\C)nc2c1c(=O)[nH]c(=O)n2C

STK526908
Synonyms: 8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-7-heptyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(N/N=C/c2ccc(cc2)Br)nc2c1c(=O)[nH]c(=O)n2C

STK526909
Synonyms: 8-(dimethylamino)-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(C)C

STK526910
Synonyms: 4-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-N,N-diethylaniline
Smiles: CCN(c1ccc(cc1)C1SCc2c(CS1)cc(c(c2)C)C)CC

STK526911
Synonyms: 3-methyl-7-(3-methylbutyl)-8-[(2E)-2-(1-phenylbutylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCC/C(=N\Nc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C)/c1ccccc1

STK526912
Synonyms: 8-[(2E)-2-(3,4-dimethoxybenzylidene)hydrazinyl]-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(/C=N/Nc2nc3c(n2CC(COc2ccccc2C)O)c(=O)[nH]c(=O)n3C)ccc1OC

STK526913
Synonyms: 3-methyl-8-[(3-methylbutyl)sulfanyl]-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SCCC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK526914
Synonyms: (2Z)-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(4-hydroxy-3-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])O)/c1scc(n1)c1ccc(cc1Cl)Cl

STK526915
Synonyms: N-{2-[2-(4-methylphenyl)-1H-imidazo[1,2-a]benzimidazol-1-yl]ethyl}cyclohexanamine
Smiles: Cc1ccc(cc1)c1cn2c(n1CCNC1CCCCC1)nc1c2cccc1

STK526916
Synonyms: 4-{[(4-iodophenyl)amino](phenyl)methyl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Ic1ccc(cc1)NC(c1c(C)n(n(c1=O)c1ccccc1)C)c1ccccc1

STK526917
Synonyms: 3-({5-[4-(2-chlorophenyl)piperazin-1-yl]-2,4-dinitrophenyl}amino)benzoicacid
Smiles: [O-][N+](=O)c1cc([N+](=O)[O-])c(cc1N1CCN(CC1)c1ccccc1Cl)Nc1cccc(c1)C(=O)O

STK526918
Synonyms: 7-(3-bromobenzyl)-8-hydrazinyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: NNc1nc2c(n1Cc1cccc(c1)Br)c(=O)n(c(=O)n2C)C

STK526919
Synonyms: 1-(2-methyl-1H-indol-3-yl)-2-(thiomorpholin-4-yl)ethanone
Smiles: O=C(c1c(C)[nH]c2c1cccc2)CN1CCSCC1

STK526923
Synonyms: 2-[bis(4-ethylphenyl)methyl]-2-nitro-1H-indene-1,3(2H)-dione
Smiles: CCc1ccc(cc1)C(C1([N+](=O)[O-])C(=O)c2c(C1=O)cccc2)c1ccc(cc1)CC

STK526925
Synonyms: 3-[(cyclohexylamino)methyl]-4-methoxybenzaldehyde
Smiles: COc1ccc(cc1CNC1CCCCC1)C=O

STK526926
Synonyms: ethyl2-(4-{[(diethoxyphosphoryl)(4-methoxyphenyl)methyl]amino}-3-methylphenyl)-3,3,3-trifluoro-2-hydroxypropanoate
Smiles: CCOP(=O)(C(c1ccc(cc1)OC)Nc1ccc(cc1C)C(C(F)(F)F)(C(=O)OCC)O)OCC

STK526927
Synonyms: ethyl(2Z)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-5-methyl-3-oxo-7-phenyl-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)n2c(=NC1c1ccccc1)s/c(=C\1/c3ccccc3N(C1=O)CC)/c2=O

STK526928
Synonyms: methyl5-bromo-3-({[4-(ethoxycarbonyl)piperidin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK526931
Synonyms: 3-methyl-8-[(4-methylbenzyl)amino]-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(NCc2ccc(cc2)C)nc2c1c(=O)[nH]c(=O)n2C)C

STK526932
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-(3-methylbutyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)NCCC(C)C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK526934
Synonyms: 4-(4-bromophenyl)-2-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-6-phenylpyrimidine
Smiles: Brc1ccc(cc1)c1nc(N/N=C/c2ccccc2Cl)nc(c1)c1ccccc1

STK526935
Synonyms: 4-methyl-2-{[(1Z)-4,4,8-trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]amino}phenol
Smiles: Cc1ccc(c(c1)/N=c/1\ssc2c1c1cc(C)ccc1NC2(C)C)O

STK526936
Synonyms: N,N-diethyl-3-[2-(4-methylphenyl)-1H-imidazo[1,2-a]benzimidazol-1-yl]propan-1-amine
Smiles: CCN(CCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)C)CC

STK526938
Synonyms: 3-{[(E)-(2-hydroxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: Oc1ccccc1/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1

STK526939
Synonyms: 8-methoxy-3-{[(E)-pyridin-2-ylmethylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccn1

STK526940
Synonyms: 1-methyl-3-octyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCCCCn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)c1ccccc1

STK526941
Synonyms: 2,3-dimethyl-6-(thiophen-2-yl)imidazo[1,2-b][1,2,4]triazine
Smiles: Cc1nn2cc(nc2nc1C)c1cccs1

STK526942
Synonyms: 6-nitro-3-(2-phenyl-1,3-thiazol-4-yl)-2H-chromen-2-one
Smiles: O=c1oc2ccc(cc2cc1c1csc(n1)c1ccccc1)[N+](=O)[O-]

STK526943
Synonyms: 3-(biphenyl-4-yl)-5-(furan-2-yl)-1-phenyl-4,5-dihydro-1H-pyrazole
Smiles: c1ccc(cc1)c1ccc(cc1)C1=NN(C(C1)c1ccco1)c1ccccc1

STK526945
Synonyms: 2-(4-benzylpiperazin-1-yl)-1-(1,2-dimethyl-1H-indol-3-yl)ethanone
Smiles: O=C(c1c2ccccc2n(c1C)C)CN1CCN(CC1)Cc1ccccc1

STK526946
Synonyms: 2-(4-cyclohexylpiperazin-1-yl)-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C1CCCCC1)c(n2C)C

STK526947
Synonyms: 1-heptyl-4-hydroxy-2-oxo-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCCCCCCn1c(=O)c(C(=O)N/N=C/c2cc(OC)c(cc2OC)OC)c(c2c1cccc2)O

STK526948
Synonyms: 8-[(2-hydroxyethyl)sulfanyl]-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C

STK526949
Synonyms: 8-methoxy-3-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1cc(OC)c(cc1OC)OC

STK526950
Synonyms: N-[4-({(E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)phenyl]acetamide
Smiles: N#C/C(=C\Nc1ccc(cc1)NC(=O)C)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK526951
Synonyms: 2-(2,4-dichlorophenyl)-N-(2-methoxyphenyl)quinazolin-4-amine
Smiles: COc1ccccc1Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl

STK526954
Synonyms: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)Nc2nnc(s2)CC(C)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK526955
Synonyms: 4-methyl-N-{4-methyl-1-oxo-1-[(tributylstannanyl)oxy]pentan-2-yl}benzenesulfonamide
Smiles: CCCC[Sn](OC(=O)C(NS(=O)(=O)c1ccc(cc1)C)CC(C)C)(CCCC)CCCC

STK526957
Synonyms: 6-methyl-2-({(E)-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2cccn2c2ccc(cc2)[N+](=O)[O-])sc2c1CCC(C2)C

STK526958
Synonyms: (2E)-2-[4-(heptyloxy)benzylidene]-N-[4-(propan-2-yloxy)benzyl]hydrazinecarbothioamide
Smiles: CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OC(C)C

STK526959
Synonyms: 3-(4-chlorobenzyl)-1-(2,4-dimethylphenyl)pyrrolidine-2,5-dione
Smiles: Clc1ccc(cc1)CC1CC(=O)N(C1=O)c1ccc(cc1C)C

STK526960
Synonyms: 3-methyl-7-(3-methylbenzyl)-8-(piperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1cccc(c1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1

STK526961
Synonyms: N'-[(3E)-1-(azepan-1-ylmethyl)-5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-(3,4-dimethoxyphenyl)acetohydrazide
Smiles: COc1ccc(cc1OC)CC(=O)N/N=C\1/C(=O)N(c2c1cc(Br)cc2)CN1CCCCCC1

STK526966
Synonyms: N'-{(3E)-5-bromo-1-[(dipropylamino)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-2-({[(E)-(4-methoxyphenyl)methylidene]amino}oxy)acetohydrazide
Smiles: CCCN(CN1c2ccc(cc2/C(=N\NC(=O)CO/N=C/c2ccc(cc2)OC)/C1=O)Br)CCC

STK526967
Synonyms: 2-{2-oxo-2-[4-(pyridin-2-yl)piperazin-1-yl]ethyl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCN(CC1)c1ccccn1)CN1C(=O)c2c(C1=O)cccc2

STK526971
Synonyms: 3-{[(E)-(3-bromo-2-hydroxyphenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1O)Br

STK526973
Synonyms: ethyl5-methoxy-3-{[(4-oxopiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(=O)CC1)cc(cc2)OC

STK526977
Synonyms: ethyl4-{[(diphenoxyphosphoryl)(phenyl)methyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(P(=O)(Oc1ccccc1)Oc1ccccc1)c1ccccc1

STK526979
Synonyms: 2-(4-methoxyphenyl)-2,3-dihydro-1H-1,3,2-benzodiazaphosphole2-oxide
Smiles: COc1ccc(cc1)P1(=O)Nc2c(N1)cccc2

STK526982
Synonyms: 2-(3,4-dichlorophenyl)-N-(4-methylphenyl)quinazolin-4-amine
Smiles: Cc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK526985
Synonyms: N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-3-(2-oxopyrrolidin-1-yl)benzohydrazide
Smiles: COc1ccc(cc1OC)/C=N/NC(=O)c1cccc(c1)N1CCCC1=O

STK526987
Synonyms: (4Z)-4-[(dimethylamino)methylidene]-5-oxo-4,5-dihydrofuran-2-carbaldehyde
Smiles: O=CC1=C/C(=C/N(C)C)/C(=O)O1

STK526990
Synonyms: 2-{(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}-3-methylquinoxaline
Smiles: COc1ccc(cc1)/C(=N/Nc1nc2ccccc2nc1C)/C

STK526991
Synonyms: (2E)-1-(2,4-dimethoxyphenyl)-3-[(2-hydroxyphenyl)amino]prop-2-en-1-one
Smiles: COc1cc(OC)ccc1C(=O)/C=C/Nc1ccccc1O

STK526993
Synonyms: 8-{(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-3-methyl-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)Cn1c(N/N=C(\c2ccc(cc2)Cl)/C)nc2c1c(=O)[nH]c(=O)n2C

STK526994
Synonyms: 3-[4-(dimethylamino)benzyl]-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccc(cc1)N(C)C

STK526996
Synonyms: 2-({6-[(3-hydroxyphenyl)amino]-7-nitro-2,1,3-benzoxadiazol-4-yl}amino)phenol
Smiles: Oc1cccc(c1)Nc1cc(Nc2ccccc2O)c2c(c1[N+](=O)[O-])non2

STK526997
Synonyms: (2Z,3E)-2-(1-hydroxyethylidene)-3-[(4-methylphenyl)imino]-7-nitro-2,3-dihydro-1H-inden-1-one
Smiles: Cc1ccc(cc1)/N=C\1/C(=C(/O)\C)/C(=O)c2c1cccc2[N+](=O)[O-]

STK526998
Synonyms: 8,8'-sulfanediylbis(1,7-dibenzyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione)
Smiles: Cn1c(=O)n(Cc2ccccc2)c(=O)c2c1nc(n2Cc1ccccc1)Sc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1

STK526999
Synonyms: (2,3,5,6-tetrabromobenzene-1,4-diyl)dimethanol
Smiles: OCc1c(Br)c(Br)c(c(c1Br)Br)CO

STK527001
Synonyms: methyl5-bromo-3-({[4-(4-fluorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)Br

STK527003
Synonyms: ethyl3-{[(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)acetyl]amino}-5-fluoro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cc(c(c3)OC)OC)cc(cc2)F

STK527004
Synonyms: methyl3-{[(4-cyclohexylpiperazin-1-yl)acetyl]amino}-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)cc(cc2)C

STK527007
Synonyms: 3-methyl-6-[(2E)-2-(pentafluorobenzylidene)hydrazinyl][1,2,4]triazolo[4,3-b]pyridazine
Smiles: Fc1c(/C=N/Nc2ccc3n(n2)c(C)nn3)c(F)c(c(c1F)F)F

STK527008
Synonyms: 3-[8-(hexylamino)-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]propanenitrile
Smiles: CCCCCCNc1nc2c(n1CCC#N)c(=O)[nH]c(=O)n2C

STK527009
Synonyms: 2,2'-piperazine-1,4-diylbis(1-phenylethanone)
Smiles: O=C(c1ccccc1)CN1CCN(CC1)CC(=O)c1ccccc1

STK527010
Synonyms: ethyl3-{[(4-cyclohexylpiperazin-1-yl)acetyl]amino}-5-fluoro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)cc(cc2)F

STK527013
Synonyms: (5E)-1-(2-fluorophenyl)-5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/C=C/c1ccco1)c1ccccc1F

STK527014
Synonyms: methyl3-({[4-(4-chlorophenyl)piperazin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cc(cc2)C

STK527015
Synonyms: 3-[4-(dimethylamino)benzyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CN(c1ccc(cc1)Cn1cnc2c(c1=O)[nH]c1c2cccc1)C

STK527017
Synonyms: dimethyl2-{8-methoxy-2,2-dimethyl-1-[(3-methylphenyl)carbonyl]-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Smiles: COC(=O)C1=C(S/C(=C\2/c3cccc(c3N(C(C2=S)(C)C)C(=O)c2cccc(c2)C)OC)/S1)C(=O)OC

STK527018
Synonyms: 2,5-bis(tert-butylsulfanyl)thiophene
Smiles: CC(Sc1ccc(s1)SC(C)(C)C)(C)C

STK527019
Synonyms: (2E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-(naphthalen-2-ylamino)prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc2c(c1)cccc2)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O

STK527024
Synonyms: 2-hydroxy-N'-[(1E)-1-(2-hydroxyphenyl)ethylidene]-2,2-bis(2-methoxyphenyl)acetohydrazide
Smiles: COc1ccccc1C(c1ccccc1OC)(C(=O)N/N=C(/c1ccccc1O)\C)O

STK527028
Synonyms: ethyl4,4,5,5-tetracyano-2-hydroxy-6-phenylcyclohex-1-ene-1-carboxylate
Smiles: CCOC(=O)C1=C(O)CC(C(C1c1ccccc1)(C#N)C#N)(C#N)C#N

STK527029
Synonyms: [(3-benzyl-2'-nitro-4'H-spiro[cyclohepta[d][1,3]thiazol-3-ium-2,1'-naphthalen]-4'-ylidene)(oxido)-lambda~5~-azanyl]oxidanide
Smiles: [O-][N+](=C1C=C([N+](=O)[O-])C2(c3c1cccc3)SC1=CC=CC=CC1=[N+]2Cc1ccccc1)[O-]

STK527031
Synonyms: 5-cyano-2-methyl-6-(methylsulfanyl)-4-(3-nitrophenyl)-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SC)NC(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)Nc1ccccc1)C

STK527032
Synonyms: (2E)-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(2-methyl-4-nitrophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1C)C

STK527034
Synonyms: 8-(butylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(SCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527035
Synonyms: (2E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-[(3-chloro-4-methylphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)C)/c1scc(n1)c1ccc(cc1)Br

STK527036
Synonyms: 2-methyl-4-nitro-1-(prop-2-en-1-yl)-1H-imidazole
Smiles: [O-][N+](=O)c1cn(c(n1)C)CC=C

STK527039
Synonyms: 2-{(E)-[2-(4-phenyl-1,3-selenazol-2-yl)hydrazinylidene]methyl}phenol
Smiles: Oc1ccccc1/C=N/Nc1[se]cc(n1)c1ccccc1

STK527040
Synonyms: 8-(dodecylsulfanyl)-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK527041
Synonyms: 2-hydroxy-2,2-diphenyl-N'-[phenyl(thiophen-2-yl)methyl]acetohydrazide
Smiles: O=C(C(c1ccccc1)(c1ccccc1)O)NNC(c1cccs1)c1ccccc1

STK527042
Synonyms: methyl5-chloro-3-({[4-(4-fluorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(cc2)Cl

STK527043
Synonyms: (3S,4S)-3,4-bis(pentylsulfanyl)tetrahydrothiophene1,1-dioxide
Smiles: CCCCCS[C@H]1CS(=O)(=O)C[C@@H]1SCCCCC

STK527044
Synonyms: 6-({(2E)-3-phenyl-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)/C(=C\c1ccccc1)/NC(=O)c1ccccc1

STK527045
Synonyms: 4,4'-[(4-methoxyphenyl)methanediyl]bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)
Smiles: CCCCCCn1nc(c(c1O)C(c1c(C)nn(c1O)CCCCCC)c1ccc(cc1)OC)C

STK527046
Synonyms: methyl5-bromo-3-({[4-(4-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COc1ccc(cc1)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC

STK527047
Synonyms: 3-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)OC)OC

STK527048
Synonyms: ethyl(2E)-2-[4-(acetyloxy)-3-methoxybenzylidene]-5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C\c1ccc(c(c1)OC)OC(=O)C)/s2

STK527049
Synonyms: 3-{[(E)-(2-fluorophenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Fc1ccccc1/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK527052
Synonyms: 4-(4-methylpiperazin-1-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Smiles: CN1CCN(CC1)c1nc2ccccc2n2c1nnc2

STK527053
Synonyms: 4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-1-oxaspiro[4.5]decan-2-one
Smiles: O=C1CC(C2(O1)CCCCC2)c1scc(n1)c1ccc(cc1)Cl

STK527054
Synonyms: 4-(3-benzylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccncc1)[n+]1cccc(c1)Cc1ccccc1

STK527055
Synonyms: N-(4-nitrophenyl)-2-(5-oxo-4-pentyltetrahydrofuran-2-yl)acetamide
Smiles: CCCCCC1CC(OC1=O)CC(=O)Nc1ccc(cc1)[N+](=O)[O-]

STK527056
Synonyms: N-[(4-nitrophenyl)sulfanyl]-1,1-bis[4-(trifluoromethyl)phenyl]methanimine
Smiles: [O-][N+](=O)c1ccc(cc1)S/N=C(/c1ccc(cc1)C(F)(F)F)\c1ccc(cc1)C(F)(F)F

STK527057
Synonyms: ethyl3-[(3,4-dihydroisoquinolin-2(1H)-ylacetyl)amino]-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cccc3)cc(cc2)OC

STK527058
Synonyms: 7-benzyl-3-methyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C

STK527059
Synonyms: 2-{[(2-hydroxyethyl)amino]methyl}tricyclo[3.3.1.1~3,7~]decan-2-ol
Smiles: OCCNCC1(O)C2CC3CC1CC(C2)C3

STK527060
Synonyms: 10-(pyridin-2-ylmethyl)decahydroacridine-4a,10a(2H,10H)-dicarbonitrile
Smiles: N#CC12CCCCC1CC1C(N2Cc2ccccn2)(C#N)CCCC1

STK527061
Synonyms: 8-methyl-3-{[(E)-pyridin-3-ylmethylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccnc1

STK527062
Synonyms: 2-{2-[2-(pyridin-3-yl)piperidin-1-yl]ethyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: C1CCN(C(C1)c1cccnc1)CCc1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK527063
Synonyms: (2Z)-2-(4-nitrobenzylidene)-6,7-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
Smiles: [O-][N+](=O)c1ccc(cc1)/C=c/1\sc2=NCCCn2c1=O

STK527064
Synonyms: 8-bromo-3-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(ccc1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527069
Synonyms: (2Z)-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-(2-fluorophenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1ccccc1F)/c1scc(n1)c1ccc(cc1Cl)Cl

STK527070
Synonyms: 6-(4-bromophenyl)-2,3-dimethylimidazo[1,2-b][1,2,4]triazine
Smiles: Brc1ccc(cc1)c1cn2c(n1)nc(c(n2)C)C

STK527072
Synonyms: 2-[4-(dimethylamino)phenyl]-3-(4-methoxyphenyl)-2,3-dihydroquinazolin-4(1H)-one
Smiles: COc1ccc(cc1)N1C(Nc2c(C1=O)cccc2)c1ccc(cc1)N(C)C

STK527073
Synonyms: methylN-[(2,4-dichlorophenyl)carbonyl]-2-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)phenyl]amino}-3,3,3-trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccc(cc1Cl)Cl)O

STK527075
Synonyms: 2-(2,4-dichlorophenyl)-4-[4-(diphenylmethyl)piperazin-1-yl]quinazoline
Smiles: Clc1ccc(c(c1)Cl)c1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)cccc2

STK527076
Synonyms: N-(1,3-benzothiazol-2-yl)-1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)Nc2nc3c(s2)cccc3)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527077
Synonyms: 3-(3-chlorophenyl)-1-(4-chlorophenyl)-1-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)urea
Smiles: CC1CN=C(S1)N(c1ccc(cc1)Cl)C(=O)Nc1cccc(c1)Cl

STK527078
Synonyms: 9-(3,4-dihydroxyphenyl)-3,6-diphenyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: O=C1CC(CC2=C1C(c1ccc(c(c1)O)O)C1=C(O2)CC(CC1=O)c1ccccc1)c1ccccc1

STK527079
Synonyms: 2-{3-[(2,3-dimethylphenoxy)methyl]-4-methoxyphenyl}-3-(2-fluorophenyl)-2,3-dihydroquinazolin-4(1H)-one
Smiles: COc1ccc(cc1COc1cccc(c1C)C)C1Nc2ccccc2C(=O)N1c1ccccc1F

STK527082
Synonyms: ethyl1-(4-bromophenyl)-4,6-diphenyl-1,4-dihydro-1,2,4-diazaphosphinine-3-carboxylate4-sulfide
Smiles: CCOC(=O)C1=NN(c2ccc(cc2)Br)C(=CP1(=S)c1ccccc1)c1ccccc1

STK527085
Synonyms: 4-{(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-(2,4-dichlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl)/C

STK527086
Synonyms: 2,2',2''-methanetriyltris[5-(3-chlorophenyl)furan]
Smiles: Clc1cccc(c1)c1ccc(o1)C(c1ccc(o1)c1cccc(c1)Cl)c1ccc(o1)c1cccc(c1)Cl

STK527087
Synonyms: 1-{(E)-[2-(4,6-diphenylpyrimidin-2-yl)hydrazinylidene]methyl}naphthalen-2-ol
Smiles: Oc1ccc2c(c1/C=N/Nc1nc(cc(n1)c1ccccc1)c1ccccc1)cccc2

STK527088
Synonyms: 7-[(2E)-but-2-en-1-yl]-3-methyl-8-(propan-2-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C=C/Cn1c(SC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK527089
Synonyms: 3-(7-hydroxy-1-methyl-2,4-dioxo-9-phenyl-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl)propanenitrile
Smiles: N#CCCn1c(=O)n(C)c2c(c1=O)n1CC(O)CN(c1n2)c1ccccc1

STK527090
Synonyms: 1-(cyclopropylcarbonyl)-2-(3-nitrophenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Smiles: N#CC1(C#N)C(c2cccc(c2)[N+](=O)[O-])C(N2C1C=Cc1c2cccc1)C(=O)C1CC1

STK527091
Synonyms: 2-({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}amino)-4-(4-nitrophenoxy)naphthalen-1-ol
Smiles: CCC(c1cc(ccc1OCCCCNc1cc(Oc2ccc(cc2)[N+](=O)[O-])c2c(c1O)cccc2)C(CC)(C)C)(C)C

STK527093
Synonyms: 3-(pyridin-2-ylmethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: O=c1n(cnc2c1[nH]c1c2cccc1)Cc1ccccn1

STK527095
Synonyms: methyl3-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(c1ccccc1)c1ccccc1)cccc2

STK527097
Synonyms: (5Z)-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)-1-(2,4,6-trimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1cc(C)c(c(c1)C)N1C(=O)NC(=O)/C(=C/NN2CCCCC2c2cccnc2)/C1=O

STK527101
Synonyms: 7-decyl-3-methyl-8-[(2-oxo-2-phenylethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCn1c(SCC(=O)c2ccccc2)nc2c1c(=O)[nH]c(=O)n2C

STK527105
Synonyms: 2-(4-chlorophenyl)-4-[(2E)-2-(1-phenylethylidene)hydrazinyl]quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C(/c2ccccc2)\C)c2c(n1)cccc2

STK527106
Synonyms: 1-(2-methyl-1H-indol-3-yl)-2-(2-methylpiperidin-1-yl)ethanone
Smiles: CC1CCCCN1CC(=O)c1c(C)[nH]c2c1cccc2

STK527107
Synonyms: 8-bromo-3-{[(E)-(4-chlorophenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527108
Synonyms: 3-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(ccc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK527110
Synonyms: 5-[(E)-{2-[3-(9H-carbazol-9-yl)propanoyl]hydrazinylidene}methyl]-4-(4-methylpyridinium-1-yl)-2-oxo-1,3-thiazol-3-ide
Smiles: O=C(CCn1c2ccccc2c2c1cccc2)N/N=C/c1sc(=O)[n-]c1[n+]1ccc(cc1)C

STK527112
Synonyms: 1-phenyl-4-[(2,4,6-trichlorophenoxy)methyl]-1H-1,2,3-triazole
Smiles: Clc1cc(Cl)c(c(c1)Cl)OCc1nnn(c1)c1ccccc1

STK527116
Synonyms: 3,4-dichloro-1-{2-oxo-2-[(tributylstannanyl)oxy]ethyl}-1H-pyrrole-2,5-dione
Smiles: CCCC[Sn](OC(=O)CN1C(=O)C(=C(C1=O)Cl)Cl)(CCCC)CCCC

STK527119
Synonyms: methyl(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)acetate
Smiles: COC(=O)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527121
Synonyms: methyl5-methyl-3-({[4-(4-nitrobenzyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccc(cc1)[N+](=O)[O-])cc(cc2)C

STK527122
Synonyms: 8-(dodecylsulfanyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1C)c(=O)[nH]c(=O)n2C

STK527123
Synonyms: 8-bromo-3-({(E)-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: C=CCc1cccc(c1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br

STK527124
Synonyms: 4-(3,3-dimethylpiperidin-1-yl)-8-methyl-5H-pyrimido[5,4-b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCC(C1)(C)C

STK527125
Synonyms: N-(6-methyl-1,3-benzothiazol-2-yl)-N'-(propan-2-yl)butanediamide
Smiles: CC(NC(=O)CCC(=O)Nc1nc2c(s1)cc(cc2)C)C

STK527128
Synonyms: 1-(2-methoxyphenyl)-4-{2-[2-(naphthalen-1-yloxy)ethoxy]ethyl}piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCOCCOc1cccc2c1cccc2

STK527129
Synonyms: ethyl(2E)-7-methyl-3-oxo-5-[(E)-2-phenylethenyl]-2-[(2Z)-3-phenylprop-2-en-1-ylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1/C=C/c1ccccc1)c(=O)/c(=C\C=C/c1ccccc1)/s2

STK527132
Synonyms: 3-{[(E)-(2,4-dichlorophenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1ccc(c(c1)Cl)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527134
Synonyms: 3-{[(E)-(2,4-dihydroxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Oc1ccc(c(c1)O)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK527135
Synonyms: 3-chloro-N-[(1Z)-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]-4-methylaniline
Smiles: Cc1ccc(cc1Cl)/N=c/1\ssc2c1c1ccccc1NC2(C)C

STK527136
Synonyms: 4-hydroxy-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCn1c(=O)c(C(=O)Nc2ccc(cc2)c2sc3c(n2)ccc(c3)C)c(c2c1cccc2)O

STK527138
Synonyms: 4-hydroxy-1-methyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: Cc1ccc2c(c1)sc(n2)c1ccc(cc1)NC(=O)c1c(O)c2ccccc2n(c1=O)C

STK527141
Synonyms: ethyl3-{[(4-ethylpiperazin-1-yl)acetyl]amino}-5-fluoro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)CC)cc(cc2)F

STK527142
Synonyms: (2Z)-3-[(2,5-dimethylphenyl)amino]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cc(C)ccc1C)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]

STK527143
Synonyms: N-[(E)-{3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylidene]-4H-1,2,4-triazol-3-amine
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)/C=N/c1nnc[nH]1

STK527144
Synonyms: 2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine-3,4-dicarbonitrile
Smiles: N#Cc1c(C#N)c(Cl)nc2c1CCC2

STK527147
Synonyms: 5-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-6-hydroxy-3-phenyl-2-(prop-2-en-1-ylsulfanyl)pyrimidin-4(3H)-one
Smiles: C=CCSc1nc(O)c(c(=O)n1c1ccccc1)C1OC(=O)c2c1ccc(c2OC)OC

STK527148
Synonyms: N-{(2E)-3-(3-nitrophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}glycine
Smiles: OC(=O)CNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1

STK527151
Synonyms: 4-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-2-(4-chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl

STK527153
Synonyms: 9-(1-butoxyethyl)-3-nitro-9H-carbazole
Smiles: CCCCOC(n1c2ccc(cc2c2c1cccc2)[N+](=O)[O-])C

STK527154
Synonyms: 8-methoxy-3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C(C)C

STK527155
Synonyms: 3-methyl-7-(3-phenylpropyl)-8-[(3-phenylpropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)[nH]c(=O)c2c1nc(n2CCCc1ccccc1)SCCCc1ccccc1

STK527156
Synonyms: (5E)-1-(2-methoxyphenyl)-5-[(2E)-3-phenylprop-2-en-1-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccccc1N1C(=O)NC(=O)/C(=C\C=C\c2ccccc2)/C1=O

STK527157
Synonyms: N-{1,1,1,3,3,3-hexafluoro-2-[(2-methoxyethyl)amino]propan-2-yl}acetamide
Smiles: COCCNC(C(F)(F)F)(C(F)(F)F)NC(=O)C

STK527158
Synonyms: 3-bromo-1-{(E)-[(5-methylpyridin-2-yl)imino]methyl}-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ol
Smiles: Cc1ccc(nc1)/N=C/c1c(O)c(Br)cc2c1c1CCCCc1o2

STK527159
Synonyms: methyl3-{[N-(1,3-benzodioxol-5-yl)-N-ethylglycyl]amino}-1H-indole-2-carboxylate
Smiles: CCN(c1ccc2c(c1)OCO2)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK527160
Synonyms: 3-chloro-7-[(4-methylphenyl)amino]-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Cc1ccc(cc1)Nc1cc2oc3cc(Cl)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1

STK527163
Synonyms: propyl[(3-cyano-4,6-diphenylpyridin-2-yl)sulfanyl]acetate
Smiles: CCCOC(=O)CSc1nc(cc(c1C#N)c1ccccc1)c1ccccc1

STK527165
Synonyms: 4-[nitroso(phenyl)amino]phenylacetate
Smiles: O=NN(c1ccccc1)c1ccc(cc1)OC(=O)C

STK527166
Synonyms: 2-[2-hydroxy-3-(3-methylbutoxy)propyl]propanediamide
Smiles: OC(CC(C(=O)N)C(=O)N)COCCC(C)C

STK527167
Synonyms: 2,7-bis(azepan-1-ylmethyl)-1,8-bis(4-methoxyphenyl)octane-1,8-dione
Smiles: COc1ccc(cc1)C(=O)C(CN1CCCCCC1)CCCCC(C(=O)c1ccc(cc1)OC)CN1CCCCCC1

STK527168
Synonyms: (5Z)-1-(naphthalen-1-yl)-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\NN1CCCCC1c1cccnc1)c1cccc2c1cccc2

STK527169
Synonyms: 3-methyl-7-pentyl-8-(propylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(SCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527170
Synonyms: 1-(5-methoxy-1H-indol-3-yl)-2-(piperidin-1-yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCCCC1

STK527171
Synonyms: 1-(1,2-dimethyl-1H-indol-3-yl)-2-(4-ethylpiperazin-1-yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c(C)n(c2c1cccc2)C

STK527172
Synonyms: 2-oxo-2H-chromen-4-yl(2-nitrophenyl)acetate
Smiles: O=C(Cc1ccccc1[N+](=O)[O-])Oc1cc(=O)oc2c1cccc2

STK527173
Synonyms: 2-(4-chlorophenyl)-4-(2-methylphenoxy)quinazoline
Smiles: Clc1ccc(cc1)c1nc(Oc2ccccc2C)c2c(n1)cccc2

STK527174
Synonyms: 1-[5-(bromomethyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-yl]-1-(4-methylphenyl)-3-phenylurea
Smiles: BrCC1(C)CN=C(S1)N(C(=O)Nc1ccccc1)c1ccc(cc1)C

STK527175
Synonyms: N-butyl-1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK527176
Synonyms: (2E)-2-cyano-N-[2-(dimethylamino)ethyl]-3-[5-(4-methylphenyl)furan-2-yl]prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)c1ccc(cc1)C)/C(=O)NCCN(C)C

STK527178
Synonyms: 3-(furan-2-ylmethyl)-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccco1

STK527179
Synonyms: N-[(1E)-3-oxo-1-phenyl-3-{[6-({(2Z)-3-phenyl-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)hexyl]amino}prop-1-en-2-yl]benzamide
Smiles: O=C(/C(=C/c1ccccc1)/NC(=O)c1ccccc1)NCCCCCCNC(=O)/C(=C\c1ccccc1)/NC(=O)c1ccccc1

STK527181
Synonyms: 2-[4-(4-chlorophenyl)piperazin-1-yl]-1-(1,2-dimethyl-1H-indol-3-yl)ethanone
Smiles: Clc1ccc(cc1)N1CCN(CC1)CC(=O)c1c(C)n(c2c1cccc2)C

STK527182
Synonyms: 3-(furan-2-ylmethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: O=c1n(cnc2c1[nH]c1c2cccc1)Cc1ccco1

STK527183
Synonyms: 1-(1,2-dimethyl-1H-indol-3-yl)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone
Smiles: Cc1c(C)cccc1N1CCN(CC1)CC(=O)c1c2ccccc2n(c1C)C

STK527185
Synonyms: 4-(morpholin-4-yl)[1,2,4]triazolo[4,3-a]quinoxaline
Smiles: O1CCN(CC1)c1nc2ccccc2n2c1nnc2

STK527187
Synonyms: ethyl3-[(E)-(4-carbamoylpiperidin-1-yl)diazenyl]-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CC[C@H](CC1)C(=O)N)cc(cc2)OC

STK527189
Synonyms: methyl5-bromo-3-{[(4-cyclohexylpiperazin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1CCCCC1)cc(cc2)Br

STK527190
Synonyms: N-({2-[(difluoromethyl)sulfanyl]phenyl}carbamoyl)-2,6-difluorobenzamide
Smiles: O=C(Nc1ccccc1SC(F)F)NC(=O)c1c(F)cccc1F

STK527191
Synonyms: N-[(E)-(3-{[4-chloro-5-methyl-2-(propan-2-yl)phenoxy]methyl}-4-methoxyphenyl)methylidene]morpholin-4-amine
Smiles: COc1ccc(cc1COc1cc(C)c(cc1C(C)C)Cl)/C=N/N1CCOCC1

STK527192
Synonyms: 2-{[(E)-1H-indol-3-ylmethylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2c[nH]c3c2cccc3)sc2c1CCN(C2)C

STK527193
Synonyms: 2-{(E)-[(5-methylpyridin-2-yl)imino]methyl}-4-nitronaphthalen-1-ol
Smiles: Cc1ccc(nc1)/N=C/c1cc([N+](=O)[O-])c2c(c1O)cccc2

STK527194
Synonyms: 6-(4-fluorophenoxy)-N-(furan-2-ylmethyl)hexan-1-amine
Smiles: Fc1ccc(cc1)OCCCCCCNCc1ccco1

STK527195
Synonyms: 1-(2-methoxyethyl)-1-(2-methylphenyl)-3-phenylurea
Smiles: COCCN(c1ccccc1C)C(=O)Nc1ccccc1

STK527199
Synonyms: N,N-diethyl-2-{2-imino-3-[(octyloxy)methyl]-2,3-dihydro-1H-benzimidazol-1-yl}ethanamine
Smiles: CCCCCCCCOCn1c2ccccc2n(c1=N)CCN(CC)CC

STK527200
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-(5-nitro-1,3-thiazol-2-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)Nc2ncc(s2)[N+](=O)[O-])c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527201
Synonyms: N-(4-bromophenyl)-4-ethoxy-3-(1-methyl-7-oxo-3-propyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)Nc1ccc(cc1)Br)C

STK527202
Synonyms: 1-chloro-3-{[(2Z)-3-phenyl-1,3-benzothiazol-2(3H)-ylidene]amino}propan-2-ol
Smiles: ClCC(C/N=c/1\sc2c(n1c1ccccc1)cccc2)O

STK527203
Synonyms: (2E,2'E)-3,3'-[methanediylbis(benzene-4,1-diylimino)]bis[1-(2,4-dimethoxyphenyl)prop-2-en-1-one]
Smiles: COc1cc(OC)ccc1C(=O)/C=C/Nc1ccc(cc1)Cc1ccc(cc1)N/C=C/C(=O)c1ccc(cc1OC)OC

STK527204
Synonyms: 2-(4-amino-3,5-dibromophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylicacid
Smiles: OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cc(Br)c(c(c1)Br)N

STK527206
Synonyms: 2,6-difluoro-N-({3-[(heptafluoropropyl)sulfanyl]phenyl}carbamoyl)benzamide
Smiles: O=C(NC(=O)c1c(F)cccc1F)Nc1cccc(c1)SC(C(C(F)(F)F)(F)F)(F)F

STK527207
Synonyms: 8-(butan-2-ylsulfanyl)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SC(CC)C)nc2c1c(=O)[nH]c(=O)n2C

STK527208
Synonyms: [(7-hexadecyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]aceticacid
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C

STK527209
Synonyms: N'-[(1E)-1-(6-methoxy-2-oxo-2H-chromen-3-yl)ethylidene]pyridine-4-carbohydrazide
Smiles: COc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccncc1)/C

STK527210
Synonyms: 3-{[(E)-(4-hydroxyphenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Oc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1

STK527211
Synonyms: N-(2,4-dichlorophenyl)-2-(3,4-dichlorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(c(c1)Cl)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527212
Synonyms: (2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(4-ethoxyphenyl)amino]prop-2-enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(/c1scc(n1)c1ccc2c(c1)OCO2)\C#N

STK527213
Synonyms: 1-(benzyloxy)-3-(morpholin-4-yl)propan-2-ylphenylacetate
Smiles: O=C(Cc1ccccc1)OC(CN1CCOCC1)COCc1ccccc1

STK527215
Synonyms: ethyl3-[(E)-3,4-dihydroisoquinolin-2(1H)-yldiazenyl]-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCc3c(C1)cccc3)cc(cc2)OC

STK527218
Synonyms: 1-methyl-7-(pyrrolidin-1-yl)-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: O=c1c2c(cc3c(c2c(=O)c2c1cccc2)[nH]c1c(o3)cccc1C)N1CCCC1

STK527219
Synonyms: tetramethyl6'-[(4-methoxyphenyl)carbonyl]-5',5',7'-trimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate
Smiles: COc1ccc(cc1)C(=O)N1c2c(C)cccc2C2=C(C1(C)C)SC(=C(C12SC(=C(S1)C(=O)OC)C(=O)OC)C(=O)OC)C(=O)OC

STK527220
Synonyms: 4-ethoxy-3-(1-methyl-7-oxo-3-propyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-N,N-dipentylbenzenesulfonamide
Smiles: CCCCCN(S(=O)(=O)c1ccc(c(c1)c1[nH]c(=O)c2c(n1)c(CCC)nn2C)OCC)CCCCC

STK527221
Synonyms: 7-[(2E)-but-2-en-1-yl]-8-(heptylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1C/C=C/C)c(=O)[nH]c(=O)n2C

STK527223
Synonyms: 3-[2-(4-bromophenyl)-1H-imidazo[1,2-a]benzimidazol-1-yl]-N,N-diethylpropan-1-amine
Smiles: CCN(CCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Br)CC

STK527225
Synonyms: 3-{[(E)-(2-chlorophenyl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccc1Cl

STK527226
Synonyms: 6,6'-(butane-1,4-diyldisulfanediyl)bis[4-(4-butoxyphenyl)-5-cyano-2-methyl-N-phenylpyridine-3-carboxamide]
Smiles: CCCCOc1ccc(cc1)c1c(C#N)c(SCCCCSc2nc(C)c(c(c2C#N)c2ccc(cc2)OCCCC)C(=O)Nc2ccccc2)nc(c1C(=O)Nc1ccccc1)C

STK527227
Synonyms: methyl3-[({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}acetyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C/C=C/c1ccccc1)cccc2

STK527228
Synonyms: 4-ethoxy-N-[(E)-furan-2-ylmethylidene]aniline
Smiles: CCOc1ccc(cc1)/N=C/c1ccco1

STK527229
Synonyms: 1-naphthalen-1-yl-3-(4-phenylquinolin-8-yl)urea
Smiles: O=C(Nc1cccc2c1cccc2)Nc1cccc2c1nccc2c1ccccc1

STK527231
Synonyms: N-(3-chlorophenyl)-2-(4-chlorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(cc1)c1nc(Nc2cccc(c2)Cl)c2c(n1)cccc2

STK527232
Synonyms: 7-bromo-6-methyl-2,3-diphenyl-7H-imidazo[1,2-b][1,2,4]triazepin-8(9H)-one
Smiles: O=C1Nc2nc(c(n2N=C(C1Br)C)c1ccccc1)c1ccccc1

STK527233
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-4-hydroxy-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydroquinoline-3-carboxamide
Smiles: C=CCn1c(=O)c(C(=O)NCc2ccc3c(c2)OCO3)c(c2c1cccc2)O

STK527237
Synonyms: methyl3-amino-4-(2-methoxyphenyl)-6-phenylthieno[2,3-b]pyridine-2-carboxylate
Smiles: COc1ccccc1c1cc(nc2c1c(N)c(s2)C(=O)OC)c1ccccc1

STK527239
Synonyms: 3-methyl-7-octyl-8-(prop-2-en-1-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SCC=C)nc2c1c(=O)[nH]c(=O)n2C

STK527240
Synonyms: 2-(2-chlorophenyl)-4-{(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl)/C

STK527241
Synonyms: N-[(4-ethoxyphenyl)carbonyl]glycylglycine
Smiles: CCOc1ccc(cc1)C(=O)NCC(=O)NCC(=O)O

STK527242
Synonyms: 2-amino-4-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-6-(methylsulfanyl)pyrimidine-5-carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)Br)nc(nc1SC)N

STK527243
Synonyms: 3-[(3-methyl-7-nonyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]propanoicacid
Smiles: CCCCCCCCCn1c(SCCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C

STK527245
Synonyms: ethyl3-{[(3,3-dimethylpiperidin-1-yl)acetyl]amino}-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)(C)C)cc(cc2)OC

STK527247
Synonyms: 7-hexadecyl-3-methyl-8-(propan-2-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK527249
Synonyms: ethyl(6-bromo-2-oxo-1,3-benzoxazol-3(2H)-yl)acetate
Smiles: CCOC(=O)Cn1c(=O)oc2c1ccc(c2)Br

STK527250
Synonyms: 3-(3-bromophenyl)-2-(3,4,5-trimethoxyphenyl)-2,3-dihydroquinazolin-4(1H)-one
Smiles: COc1c(OC)cc(cc1OC)C1Nc2ccccc2C(=O)N1c1cccc(c1)Br

STK527251
Synonyms: N-{4-tert-butyl-1-[1-(2-methylphenyl)-1H-tetrazol-5-yl]cyclohexyl}-3-methyl-N-nitrosoaniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1ccccc1C)c1cccc(c1)C

STK527252
Synonyms: N-decyl-1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK527253
Synonyms: N-[2-(difluoromethoxy)phenyl]-2,2,3,3,4,4,4-heptafluorobutanamide
Smiles: FC(Oc1ccccc1NC(=O)C(C(C(F)(F)F)(F)F)(F)F)F

STK527254
Synonyms: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-propyl-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F

STK527258
Synonyms: 3-methyl-8-(methylsulfanyl)-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SC)nc2c1c(=O)[nH]c(=O)n2C

STK527261
Synonyms: 1-ethyl-6-fluoro-N-(2-fluorobenzyl)-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)NCc2ccccc2F)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527263
Synonyms: N,N'-di-tert-butyl-1,5-dimethyl-9-oxo-3,7-diazabicyclo[3.3.1]nonane-3,7-dicarbothioamide
Smiles: S=C(N1CC2(C)CN(CC(C1)(C2=O)C)C(=S)NC(C)(C)C)NC(C)(C)C

STK527266
Synonyms: dimethyl[(3,4-dichlorophenyl)(phenylamino)methyl]phosphonate
Smiles: COP(=O)(C(c1ccc(c(c1)Cl)Cl)Nc1ccccc1)OC

STK527268
Synonyms: 2-(2-chlorophenyl)-4-[(2E)-2-(3-methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cccc(c1)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl

STK527272
Synonyms: N-(4-methoxybenzyl)-N-[4-(9H-thioxanthen-9-yl)phenyl]morpholine-4-carboxamide
Smiles: COc1ccc(cc1)CN(C(=O)N1CCOCC1)c1ccc(cc1)C1c2ccccc2Sc2c1cccc2

STK527273
Synonyms: 3-({(E)-[3-(hydroxymethyl)-4-methoxyphenyl]methylidene}amino)-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)CO)OC

STK527275
Synonyms: 4,4'-propane-1,1-diylbis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Smiles: CCC(c1c(C)n(n(c1=O)c1ccccc1)C)c1c(C)n(n(c1=O)c1ccccc1)C

STK527276
Synonyms: 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-{(2Z)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(N/N=C(\c2ccc(cc2)[N+](=O)[O-])/C)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1C

STK527277
Synonyms: 2-({[(E)-(2-chlorophenyl)methylidene]amino}oxy)-N'-[(3E)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]acetohydrazide
Smiles: O=C(N/N=C\1/C(=O)Nc2c1cccc2)CO/N=C/c1ccccc1Cl

STK527278
Synonyms: 4-(4-tert-butylpyridinium-1-yl)-5-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-oxo-1,3-thiazol-3-ide
Smiles: NC(=S)N/N=C/c1sc(=O)[n-]c1[n+]1ccc(cc1)C(C)(C)C

STK527280
Synonyms: 4-[(8-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)methyl]benzonitrile
Smiles: N#Cc1ccc(cc1)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)C

STK527281
Synonyms: 2-({(E)-[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylidene}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2cccn2c2ccc(cc2)[N+](=O)[O-])sc2c1CCC2

STK527282
Synonyms: 4-[(E)-(4-hydroxy-3-{[(tributylstannanyl)oxy]carbonyl}phenyl)diazenyl]-N-(pyridin-2-yl)benzenesulfonamide
Smiles: CCCC[Sn](OC(=O)c1cc(/N=N/c2ccc(cc2)S(=O)(=O)Nc2ccccn2)ccc1O)(CCCC)CCCC

STK527283
Synonyms: 4-[2-amino-3-cyano-6-methyl-4,4-bis(trifluoromethyl)pyridin-1(4H)-yl]benzenesulfonamide
Smiles: N#CC1=C(N)N(C(=CC1(C(F)(F)F)C(F)(F)F)C)c1ccc(cc1)S(=O)(=O)N

STK527284
Synonyms: N-[3-(dimethylamino)propyl]-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)NCCCN(C)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F

STK527286
Synonyms: (4Z)-4-[(morpholin-4-ylamino)methylidene]-2-phenyl-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\NN1CCOCC1)c1ccccc1

STK527288
Synonyms: 2-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C1c3ccccc3c3c1cccc3)c(n2C)C

STK527289
Synonyms: 2-{[(E)-1H-benzimidazol-2-ylmethylidene]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2nc3c([nH]2)cccc3)sc2c1CCC(C2)C

STK527290
Synonyms: 3-{[(E)-(2,4-dimethoxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc(c(c1)OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK527291
Synonyms: N'-[(E)-biphenyl-3-ylmethylidene]-2-bromobenzohydrazide
Smiles: O=C(c1ccccc1Br)N/N=C/c1cccc(c1)c1ccccc1

STK527292
Synonyms: 3-{[(E)-(2-chlorophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1ccccc1/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1

STK527293
Synonyms: 3-methyl-7-(3-methylbutyl)-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C)C

STK527294
Synonyms: 6-bromo-2-{(2Z)-2-[1-(1-methyl-1H-benzimidazol-2-yl)ethylidene]hydrazinyl}-4-phenylquinazoline
Smiles: Brc1ccc2c(c1)c(nc(n2)N/N=C(\c1nc2c(n1C)cccc2)/C)c1ccccc1

STK527297
Synonyms: methyl3-{[2-(3,4-dichlorophenyl)quinazolin-4-yl]amino}benzoate
Smiles: COC(=O)c1cccc(c1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl

STK527298
Synonyms: 2-(4-chlorophenyl)-4-[4-(diphenylmethyl)piperazin-1-yl]quinazoline
Smiles: Clc1ccc(cc1)c1nc(N2CCN(CC2)C(c2ccccc2)c2ccccc2)c2c(n1)cccc2

STK527299
Synonyms: 3-[2-(pyrrolidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: O=c1n(CCN2CCCC2)cnc2c1[nH]c1c2cccc1

STK527300
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-(3-methylpyridin-2-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)Nc2ncccc2C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F

STK527301
Synonyms: 1a,2a,3,6,6a,7a-hexahydro-3,6-methanonaphtho[2,3-b]oxirene-2,7-dione
Smiles: O=C1C2C3C=CC(C2C(=O)C2C1O2)C3

STK527302
Synonyms: 8-methyl-3-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(/C=N/n2cnc3c(c2=O)[nH]c2c3cc(cc2)C)cc(c1OC)OC

STK527303
Synonyms: 1-(1H-indol-3-yl)-2-(4-phenylpiperazin-1-yl)ethanone
Smiles: O=C(c1c[nH]c2c1cccc2)CN1CCN(CC1)c1ccccc1

STK527304
Synonyms: methyl5-methyl-3-{[3-(4-phenylpiperazin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1)cc(cc2)C

STK527305
Synonyms: methyl3-({[4-(4-chlorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cccc2

STK527306
Synonyms: N-{2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-4-methoxybenzamide
Smiles: N#Cc1c(sc(c1CC)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccc(cc1)OC

STK527308
Synonyms: 7-(butan-2-yl)-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCC(n1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)C)C

STK527309
Synonyms: 2-[3-(2-chlorobenzyl)-2-imino-2,3-dihydro-1H-benzimidazol-1-yl]-1-(3,4-dichlorophenyl)ethanol
Smiles: OC(c1ccc(c(c1)Cl)Cl)Cn1c2ccccc2n(c1=N)Cc1ccccc1Cl

STK527311
Synonyms: diethyl(pentabromobenzyl)propanedioate
Smiles: CCOC(=O)C(C(=O)OCC)Cc1c(Br)c(Br)c(c(c1Br)Br)Br

STK527312
Synonyms: methyl4-[(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)amino]benzoate
Smiles: COC(=O)c1ccc(cc1)/N=C/1\C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C

STK527314
Synonyms: 3-methyl-N-(propan-2-yl)[1,2,4]triazolo[4,3-b]pyridazin-6-amine
Smiles: CC(Nc1ccc2n(n1)c(C)nn2)C

STK527316
Synonyms: N-{4-[(2-methoxy-5-{(E)-[(8-methoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)imino]methyl}benzyl)oxy]phenyl}acetamide
Smiles: COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC

STK527317
Synonyms: 8-(butylsulfanyl)-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SCCCC)nc2c1c(=O)[nH]c(=O)n2C

STK527320
Synonyms: (5Z)-5-(2,4-dimethoxybenzylidene)-1-(naphthalen-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(c(c1)OC)/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc2c1cccc2

STK527321
Synonyms: 1,7-dibenzyl-8-[(2E)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc2c(c1)/C(=N\Nc1nc3c(n1Cc1ccccc1)c(=O)n(c(=O)n3C)Cc1ccccc1)/C(=O)N2

STK527322
Synonyms: ethyl6-fluoro-1-heptyl-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: CCCCCCCn1cc(C(=O)OCC)c(=O)c2c1ccc(c2)F

STK527325
Synonyms: ethyl(2E)-2-[2-(acetyloxy)-5-bromobenzylidene]-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(Br)ccc1OC(=O)C)/s2

STK527326
Synonyms: methyl3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1OC)cccc2

STK527327
Synonyms: 8-bromo-3-(pyridin-3-ylmethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1cccnc1

STK527328
Synonyms: diethyl(3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)propanedioate
Smiles: CCOC(=O)C(c1cc(Br)c2c3c1C(=O)c1ccccc1c3on2)C(=O)OCC

STK527329
Synonyms: N-octyl-2-(phenylamino)pyridine-3-carboxamide
Smiles: CCCCCCCCNC(=O)c1cccnc1Nc1ccccc1

STK527330
Synonyms: 4-butoxy-N-[(1E)-3-hydrazinyl-1-(4-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide
Smiles: CCCCOc1ccc(cc1)C(=O)N/C(=C/c1ccc(cc1)OC)/C(=O)NN

STK527331
Synonyms: 8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-7-[(2Z)-3-chlorobut-2-en-1-yl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C(=C/Cn1c(N/N=C/c2ccc(cc2)Br)nc2c1c(=O)[nH]c(=O)n2C)/Cl

STK527332
Synonyms: N'-[3-methyl-7-(2-methylpropyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]formichydrazide
Smiles: O=CNNc1nc2c(n1CC(C)C)c(=O)[nH]c(=O)n2C

STK527334
Synonyms: ethyl3,3,3-trifluoro-2-[(4-methylphenyl)amino]-N-(phenylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)Nc1ccc(cc1)C

STK527335
Synonyms: 1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-(3,3-dimethylpiperidin-1-yl)ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCCC(C1)(C)C)c(n2Cc1ccccc1)C

STK527336
Synonyms: (2Z,7Z)-2,7-bis[(5-methylthiophen-2-yl)methylidene]cycloheptanone
Smiles: Cc1ccc(s1)/C=C\1/CCCC/C(=C/c2ccc(s2)C)/C1=O

STK527337
Synonyms: 4-[(E)-{2-[2-(4-chlorophenyl)quinazolin-4-yl]hydrazinylidene}methyl]-2-methoxyphenol
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccc(cc2)Cl)ccc1O

STK527338
Synonyms: 6-[(E)-(2-{[(1,3-benzodioxol-5-ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]-2,3-dimethoxybenzoicacid(non-preferredname)
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/NC(=O)CNC(=O)c1ccc2c(c1)OCO2

STK527339
Synonyms: 3-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-5,6-diphenyl-1,2,4-triazine
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/Nc1nnc(c(n1)c1ccccc1)c1ccccc1

STK527341
Synonyms: 6-amino-2-(propan-2-yl)-8-(thiophen-2-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCN(C2)C(C)C)c1cccs1)(C#N)C#N

STK527344
Synonyms: 3,3'-[(3,5-dichloro-2-methoxyphenyl)methanediyl]bis(2-methyl-1H-indole)
Smiles: COc1c(Cl)cc(cc1C(c1c(C)[nH]c2c1cccc2)c1c(C)[nH]c2c1cccc2)Cl

STK527352
Synonyms: 4-(3,5-dimethylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(pyridin-3-ylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: Cc1cc(C)c[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1cccnc1

STK527353
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-octyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F

STK527354
Synonyms: (3,4,5,6-tetrabromobenzene-1,2-diyl)dimethanol
Smiles: OCc1c(CO)c(Br)c(c(c1Br)Br)Br

STK527355
Synonyms: diethyl(2,2-bis{[(6-chloro-2-oxo-1,3-benzoxazol-3(2H)-yl)methyl]sulfanyl}-1-cyanoethenyl)phosphonate
Smiles: CCOP(=O)(/C(=C(/SCn1c(=O)oc2c1ccc(c2)Cl)\SCn1c(=O)oc2c1ccc(c2)Cl)/C#N)OCC

STK527356
Synonyms: 5-[(E)-{2-[(2-hydroxyphenyl)carbonyl]hydrazinylidene}methyl]-2-oxo-4-[4-(pyridin-4-yl)pyridinium-1-yl]-1,3-thiazol-3-ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1O)[n+]1ccc(cc1)c1ccncc1