FULL DB

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

STK538815
Synonyms: 3-(butylsulfanyl)-11-(propan-2-yl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)C(C)C

STK538816
Synonyms: 4-acetyl-5-hydroxy-3-phenylcyclohex-4-ene-1,1,2,2-tetracarbonitrile
Smiles: N#CC1(C#N)C(c2ccccc2)C(=C(CC1(C#N)C#N)O)C(=O)C

STK538817
Synonyms: 2-(phenoxymethyl)-3-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}quinazolin-4(3H)-one
Smiles: COc1cc(/C=N/n2c(COc3ccccc3)nc3c(c2=O)cccc3)cc(c1OC)OC

STK538819
Synonyms: 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]heptanamide
Smiles: Cc1ccc2c(c1)sc(n2)c1ccc(cc1)NC(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

STK538820
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-phenoxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cccc(c1)Oc1ccccc1

STK538821
Synonyms: 3-methyl-7-[2-(piperidin-1-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCN1CCCCC1)cn2)C

STK538824
Synonyms: 8-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)C)c(=O)n(c(=O)n2C)C

STK538825
Synonyms: 3-(furan-2-ylmethyl)-11-(3-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1cccc(c1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)Cc1ccco1

STK538827
Synonyms: 7,9-dichloro-5-(4-chlorophenyl)-2-(3,4-dimethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc(cc1OC)C1=NN2C(C1)c1cc(Cl)cc(c1OC2c1ccc(cc1)Cl)Cl

STK538829
Synonyms: N'-(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-2-chlorobenzohydrazide
Smiles: O=C(c1ccccc1Cl)NNc1ncnc2c1cnn2Cc1ccccc1

STK538830
Synonyms: 2-cyclopropyl-N'-[(E)-(2-methoxyphenyl)methylidene]quinoline-4-carbohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK538831
Synonyms: (2E)-N-(2,4-dichlorophenyl)-2-(3-methoxybenzylidene)hydrazinecarbothioamide
Smiles: COc1cccc(c1)/C=N/NC(=S)Nc1ccc(cc1Cl)Cl

STK538832
Synonyms: 2-{1-[4-(dimethylamino)phenyl]-5-oxo-3-(2-phenylethyl)-2-thioxoimidazolidin-4-yl}-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CC1C(=O)N(C(=S)N1CCc1ccccc1)c1ccc(cc1)N(C)C

STK538833
Synonyms: (6aR,6bS,9aR,10S)-8-(2-methoxy-5-nitrophenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1)[N+](=O)[O-]

STK538835
Synonyms: 8-(butylsulfanyl)-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK538836
Synonyms: 2-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C/C(=C\CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C)/Cl

STK538837
Synonyms: (8S,8aR,11aS,11bS)-8-[(4-bromophenyl)carbonyl]-10-(4-fluorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Br)C=Cc2c1cccc2

STK538838
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-{(E)-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}acetohydrazide
Smiles: C=CCc1cccc(c1O)/C=N/NC(=O)Cn1nnc(n1)N

STK538839
Synonyms: N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]-2-(1H-1,2,4-triazol-1-yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1cc(Br)ccc1O

STK538840
Synonyms: 2-{[9-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-1-phenylethanone
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=O)c1ccccc1)nn2)CCN(C3)C

STK538841
Synonyms: 1,3-dimethyl-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)n(c(=O)n2C)C

STK538842
Synonyms: 2-hydroxy-2-(4-nitrophenyl)ethylmorpholine-4-carbodithioate
Smiles: OC(c1ccc(cc1)[N+](=O)[O-])CSC(=S)N1CCOCC1

STK538844
Synonyms: N'-[(1E)-1-(4-methylphenyl)ethylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C(/c1ccc(cc1)C)\C

STK538845
Synonyms: 3-[3-acetyl-4-hydroxy-2-(2-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]propanoicacid
Smiles: OC(=O)CCN1C(=O)C(=C(C1c1ccccc1[N+](=O)[O-])C(=O)C)O

STK538846
Synonyms: 2-[(4-{[(4-chlorophenyl)sulfanyl]methyl}-6-hydroxypyrimidin-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethylquinolin-1(2H)-yl)ethanone
Smiles: Oc1nc(SCC(=O)N2c3cc(C)c(cc3C(=CC2(C)C)C)C)nc(c1)CSc1ccc(cc1)Cl

STK538847
Synonyms: 2-chloro-N'-(1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)benzohydrazide
Smiles: O=C(c1ccccc1Cl)NNc1ncnc2c1cnn2C

STK538848
Synonyms: 8-{(2Z)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-1,3-dimethyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(N/N=C(\c2ccc(cc2)O)/C)nc2c1c(=O)n(c(=O)n2C)C

STK538849
Synonyms: 3-{[(E)-(2-fluorophenyl)methylidene]amino}-7,8-dimethoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1cc2c(cc1OC)[nH]c1c2[nH]c(=O)n(c1=O)/N=C/c1ccccc1F

STK538850
Synonyms: 2-{[(thiophen-2-ylacetyl)carbamothioyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Smiles: O=C(NC(=S)Nc1sc2c(c1C(=O)N)CCCCCC2)Cc1cccs1

STK538852
Synonyms: 7-(2-chlorobenzyl)-1,3-dimethyl-8-[(2E)-2-(4-methylbenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK538853
Synonyms: 9-bromo-2-[4-(prop-2-en-1-yloxy)phenyl]-5-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: C=CCOc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC2c1cccs1

STK538854
Synonyms: 1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-(3-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCCC3

STK538856
Synonyms: ethyl[(4-bromophenyl)(hydroxy)methyl](phenylethynyl)phosphinate
Smiles: CCOP(=O)(C(c1ccc(cc1)Br)O)C#Cc1ccccc1

STK538858
Synonyms: (8E)-2-amino-6-benzyl-8-(4-ethoxybenzylidene)-4-(4-ethoxyphenyl)-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: CCOc1ccc(cc1)/C=C/1\CN(Cc2ccccc2)CC2=C1OC(=C(C2c1ccc(cc1)OCC)C#N)N

STK538859
Synonyms: 8-(3-methylphenyl)-9-(propylsulfanyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCc1c3cccc1

STK538861
Synonyms: 2-hydrazinyl-3-(3-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: NNc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCCC3

STK538862
Synonyms: ethyl3-{[ethoxy(oxo)acetyl]amino}-5-fluoro-1H-indole-2-carboxylate
Smiles: CCOC(=O)C(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OCC

STK538863
Synonyms: 1-amino-8,8-dimethyl-5-(morpholin-4-yl)-N,N-diphenyl-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)N(c1ccccc1)c1ccccc1

STK538864
Synonyms: {[3-cyano-4-phenyl-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}(phenyl)aceticacid
Smiles: N#Cc1c(SC(c2ccccc2)C(=O)O)nc(cc1c1ccccc1)c1cccs1

STK538865
Synonyms: 4-bromo-N-[1-(phenylcarbonyl)-1,2,3,4-tetrahydroquinolin-6-yl]benzamide
Smiles: Brc1ccc(cc1)C(=O)Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1

STK538866
Synonyms: 3-{[(E)-(3'-nitro-2,2'-bithiophen-5-yl)methylidene]amino}benzoicacid
Smiles: [O-][N+](=O)c1ccsc1c1ccc(s1)/C=N/c1cccc(c1)C(=O)O

STK538868
Synonyms: (1'R,3R,3'R)-1'-[(4-bromophenyl)carbonyl]-3'-[(3-nitrophenyl)carbonyl]-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccc(c1)[N+](=O)[O-]

STK538869
Synonyms: N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2ccc(cc2)Cl)cc(c1O)Br

STK538870
Synonyms: 2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: O=C(c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3

STK538871
Synonyms: 7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-[(2-phenylethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(NCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1

STK538872
Synonyms: (8R,8aR,11aS,11bS)-8-acetyl-10-(3-chlorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Clc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@H]2C(=O)C)C=Cc2c1cccc2

STK538873
Synonyms: 2,6-diaminopyridine-3,4,5-tricarbonitrile
Smiles: N#Cc1c(C#N)c(N)nc(c1C#N)N

STK538874
Synonyms: (6aR,6bS,9aR,10S)-10-[(4-bromophenyl)carbonyl]-2-chloro-8-(3,5-dichlorophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1[C@H]2[C@@H]([C@@H]3N1c1cc(Cl)ccc1C=C3)C(=O)N(C2=O)c1cc(Cl)cc(c1)Cl

STK538875
Synonyms: 1-(2,6-dimethyl-1H-indol-3-yl)-2-(2-ethylpiperidin-1-yl)ethanone
Smiles: CCC1CCCCN1CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK538876
Synonyms: methyl2-({[2-amino-1-(3,5-dimethylphenyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cc(C)cc(c1)C

STK538877
Synonyms: 7,9-dichloro-2-(3,4-dimethoxyphenyl)-5-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1)C1Oc2c(Cl)cc(cc2C2N1N=C(C2)c1ccc(c(c1)OC)OC)Cl

STK538878
Synonyms: 8-(benzylsulfanyl)-1,3-dimethyl-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(SCc2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK538879
Synonyms: 8-chloro-3-({(E)-[4-(prop-2-en-1-yloxy)phenyl]methylidene}amino)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: C=CCOc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)Cl

STK538881
Synonyms: N'-[(1E)-1-(4-methoxyphenyl)ethylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)CSc1ccccn1)/C

STK538885
Synonyms: ethyl2-({[(2,4-dichlorophenyl)carbonyl]carbamothioyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(cc2Cl)Cl)sc2c1CCCCC2

STK538886
Synonyms: 3-amino-N-(2-chlorobenzyl)-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)NCc1ccccc1Cl

STK538889
Synonyms: 8-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-3-methyl-7-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Cn1c(N/N=C/c2ccc(cc2)F)nc2c1c(=O)[nH]c(=O)n2C)C

STK538890
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Clc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

STK538891
Synonyms: 2-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-4,6-dimethylpyrimidine
Smiles: Clc1ccc(cc1)/C=N/Nc1nc(C)cc(n1)C

STK538892
Synonyms: 4-hydroxy-1-methyl-2-oxo-N-[2-(piperazin-1-yl)ethyl]-1,2-dihydroquinoline-3-carboxamide
Smiles: O=C(c1c(O)c2ccccc2n(c1=O)C)NCCN1CCNCC1

STK538893
Synonyms: 8-[benzyl(methyl)amino]-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(Cc1ccccc1)C

STK538894
Synonyms: 1-ethyl-4-hydroxy-2-oxo-N-[2-(piperazin-1-yl)ethyl]-1,2-dihydroquinoline-3-carboxamide
Smiles: CCn1c(=O)c(C(=O)NCCN2CCNCC2)c(c2c1cccc2)O

STK538895
Synonyms: (5Z)-1-[4-(propan-2-yl)phenyl]-5-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C/c2cc3CCCN4c3c(c2)CCC4)/C(=O)N1c1ccc(cc1)C(C)C

STK538898
Synonyms: (9E)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-7-methyl-3-(3-nitrophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: CC1C/C(=C\c2ccc(cc2)F)/C2=C(C1)C(c1ccc(cc1)F)n1c(=N2)scc1c1cccc(c1)[N+](=O)[O-]

STK538901
Synonyms: N'-[(E)-(2-hydroxyphenyl)methylidene]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccccc1O

STK538902
Synonyms: 5-(methylsulfanyl)-10-(propan-2-yl)-3-(propylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCCSc1nnc2n1c(SC)nc1c2c2CC(OCc2s1)C(C)C

STK538903
Synonyms: 3-{[(E)-(3-bromophenyl)methylidene]amino}-2-propylquinazolin-4(3H)-one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cccc(c1)Br

STK538905
Synonyms: (8S,8aR,11aS,11bS)-8-acetyl-10-(naphthalen-1-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: CC(=O)[C@@H]1[C@H]2[C@@H]([C@@H]3N1C=Cc1c3cccc1)C(=O)N(C2=O)c1cccc2c1cccc2

STK538906
Synonyms: methyl2-({[2-amino-1-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

STK538907
Synonyms: 2-[(6-amino-3,5-dicyano-4-phenylpyridin-2-yl)sulfanyl]-N-(4-fluorophenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)F)nc(c(c1c1ccccc1)C#N)N

STK538908
Synonyms: 2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2-hydroxy-5-nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK538909
Synonyms: 7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,3-dimethyl-8-(piperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCNCC1)O

STK538910
Synonyms: pentyl{[7-benzyl-3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCN(C3)Cc1ccccc1

STK538911
Synonyms: methyl2-({[(3,4-dimethoxyphenyl)carbonyl]carbamothioyl}amino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2ccc(c(c2)OC)OC)sc2c1CCCCCCCCCC2

STK538912
Synonyms: ethyl6'-amino-5'-cyano-3'-{[(4-methylphenyl)sulfanyl]methyl}-1H,2'H-spiro[piperidine-4,4'-pyrano[2,3-c]pyrazole]-1-carboxylate
Smiles: CCOC(=O)N1CCC2(CC1)C(=C(N)Oc1c2c(CSc2ccc(cc2)C)[nH]n1)C#N

STK538913
Synonyms: N'-(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-4-methylbenzohydrazide
Smiles: Cc1ccc(cc1)C(=O)NNc1ncnc2c1cnn2Cc1ccccc1

STK538914
Synonyms: (8Z)-2-amino-8-(3-fluorobenzylidene)-4-(3-fluorophenyl)-6-propyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Smiles: CCCN1C/C(=C/c2cccc(c2)F)/C2=C(C1)C(c1cccc(c1)F)C(=C(O2)N)C#N

STK538917
Synonyms: 2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1Z)-1-phenylethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C(\c1ccccc1)/C

STK538918
Synonyms: ethyl(2-chloro-1-hydroxy-1-phenylethyl)(3,3-dimethylbut-1-yn-1-yl)phosphinate
Smiles: ClCC(P(=O)(C#CC(C)(C)C)OCC)(c1ccccc1)O

STK538919
Synonyms: 2-({2-[2-(2,6-dimethyl-1H-indol-3-yl)-2-oxoethyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methyl)-1H-isoindole-1,3(2H)-dione
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCc2c(C1CN1C(=O)c3c(C1=O)cccc3)cccc2)C

STK538920
Synonyms: ethyl4-({4-[(hexyloxy)carbonyl]phenyl}amino)-8-methylquinoline-3-carboxylate
Smiles: CCCCCCOC(=O)c1ccc(cc1)Nc1c(cnc2c1cccc2C)C(=O)OCC

STK538922
Synonyms: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-3-(3-bromophenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Brc1cccc(c1)n1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)c1CC(C)(C)OCc1s2

STK538923
Synonyms: dipropan-2-yl5-[({[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}carbamothioyl)amino]-3-methylthiophene-2,4-dicarboxylate
Smiles: CC(OC(=O)c1c(NC(=S)NC(=O)c2c(C)onc2c2c(Cl)cccc2Cl)sc(c1C)C(=O)OC(C)C)C

STK538925
Synonyms: (5E)-5-[4-(diethylamino)benzylidene]-2-[4-(2-methylphenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: CCN(c1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1C)CC

STK538926
Synonyms: (2E)-3-(4-nitrophenyl)-N-[1-(phenylcarbonyl)-1,2,3,4-tetrahydroquinolin-6-yl]prop-2-enamide
Smiles: O=C(Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1)/C=C/c1ccc(cc1)[N+](=O)[O-]

STK538927
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-(4-methoxyphenyl)ethylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C(=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br)/C

STK538930
Synonyms: (8Z,8'Z)-8,8'-bis{[(4'-amino-3,3'-dimethylbiphenyl-4-yl)amino]methylidene}-1,1',6,6'-tetrahydroxy-3,3'-dimethyl-5,5'-di(propan-2-yl)-2,2'-binaphthalene-7,7'(8H,8'H)-dione
Smiles: CC(C1=C(O)C(=O)/C(=C\Nc2ccc(cc2C)c2ccc(c(c2)C)N)/c2c1cc(C)c(c2O)c1c(C)cc2c(c1O)/C(=C/Nc1ccc(cc1C)c1ccc(c(c1)C)N)/C(=O)C(=C2C(C)C)O)C

STK538932
Synonyms: (5E)-5-(2-ethoxybenzylidene)-2-[4-(2-methylphenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: CCOc1ccccc1/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccccc1C

STK538933
Synonyms: 1-(benzylsulfanyl)-4-(3-methylphenyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCc3ccccc3)nnc2n(c1=O)c1cccc(c1)C)C

STK538934
Synonyms: methyl5-chloro-3-{[2-(4-ethylpiperazin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: CCN1CCN(CC1)C(C(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC)C

STK538936
Synonyms: 2-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}-N-(2-nitrophenyl)acetamide
Smiles: O=C(Nc1ccccc1[N+](=O)[O-])CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK538937
Synonyms: 2-(3-bromo-2,6-dimethyl-4-oxoquinolin-1(4H)-yl)-N-(3-methylphenyl)acetamide
Smiles: Cc1cccc(c1)NC(=O)Cn1c(C)c(Br)c(=O)c2c1ccc(c2)C

STK538938
Synonyms: benzyl(8R,8aR)-6-amino-8-(4-bromothiophen-2-yl)-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)OCc1ccccc1)c1scc(c1)Br)(C#N)C#N

STK538939
Synonyms: 4-benzyl-1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCC(=O)c3ccc(cc3)Cl)nnc2n(c1=O)Cc1ccccc1)C

STK538940
Synonyms: 2-(2-bromophenyl)-3-(2-methoxyphenyl)quinazolin-4(3H)-one
Smiles: COc1ccccc1n1c(nc2c(c1=O)cccc2)c1ccccc1Br

STK538942
Synonyms: 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1CC(COc1ccccc1C)O)c(=O)n(c(=O)n2C)C

STK538943
Synonyms: (8S,8aR,11aS,11bS)-8-[(4-bromophenyl)carbonyl]-10-(2-methyl-5-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cc(ccc1C)[N+](=O)[O-])cccc3

STK538944
Synonyms: (2E)-N-(2,4-dichlorophenyl)-2-(2-fluorobenzylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccccc1F

STK538945
Synonyms: N'-[(E)-(3-methoxyphenyl)methylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)CSc1ccccn1

STK538946
Synonyms: 2-(5-amino-1H-tetrazol-1-yl)-N'-[(1E)-1-(4-nitrophenyl)ethylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C(/c1ccc(cc1)[N+](=O)[O-])\C

STK538948
Synonyms: methyl3-({[4-(5-chloro-2-methylphenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)cc(c(c2)OC)OC

STK538949
Synonyms: 6-amino-4-(2,4-difluorophenyl)-3-methyl-1-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1F)F)c(C)nn2c1ccc(cc1)C

STK538950
Synonyms: 1-(chloromethyl)-3-ethyl-3-methyl-3,4-dihydroisoquinoline
Smiles: ClCC1=NC(C)(CC)Cc2c1cccc2

STK538951
Synonyms: ethyl(8S,8aR)-6-amino-5,7,7-tricyano-8-(4-fluorophenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCOC(=O)N1CC=C2[C@H](C1)[C@@H](c1ccc(cc1)F)C(C(=C2C#N)N)(C#N)C#N

STK538953
Synonyms: 8-(4-benzylpiperazin-1-yl)-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1

STK538955
Synonyms: (6aR,6bS,9aR,10S)-8-(2-methyl-4-nitrophenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Cc1cc(ccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1)[N+](=O)[O-]

STK538956
Synonyms: (6aR,6bS,9aR,10S)-10-[(4-bromophenyl)carbonyl]-8-(2-methyl-5-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cc(ccc1C)[N+](=O)[O-])C=Cc1c2cccc1

STK538957
Synonyms: N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2ccc(=O)[nH]n2)ccc1O

STK538958
Synonyms: N'-[(E)-(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-2-methylquinoline-4-carbohydrazide
Smiles: Cc1nc2ccccc2c(c1)C(=O)N/N=C/c1cn(nc1C)C

STK538959
Synonyms: methyl5-bromo-3-[(phenoxycarbonyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)Oc1ccccc1)cc(cc2)Br

STK538960
Synonyms: 9-(4-chlorophenyl)-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]pyrimidin-8(9H)-one
Smiles: Clc1ccc(cc1)n1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1

STK538961
Synonyms: 2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-(4-nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(N/N=C/c1ccc(cc1)[N+](=O)[O-])CSc1nnc(n1C)c1ccccc1

STK538962
Synonyms: (4-butylphenyl)(2,2,2',2',4,4'-hexamethyl-1,2,3,4-tetrahydro-4,6'-biquinolin-1'(2'H)-yl)methanone
Smiles: CCCCc1ccc(cc1)C(=O)N1c2ccc(cc2C(=CC1(C)C)C)C1(C)CC(C)(C)Nc2c1cccc2

STK538963
Synonyms: N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccc(cc1O)O

STK538964
Synonyms: 1,3-dimethyl-7-propyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(N/N=C/c2ccncc2)nc2c1c(=O)n(c(=O)n2C)C

STK538965
Synonyms: (9E)-9-[4-(difluoromethoxy)benzylidene]-5-[4-(difluoromethoxy)phenyl]-3-(3-nitrophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: FC(Oc1ccc(cc1)/C=C/1\CCCC2=C1N=c1scc(n1C2c1ccc(cc1)OC(F)F)c1cccc(c1)[N+](=O)[O-])F

STK538966
Synonyms: N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)NC(=N)N

STK538968
Synonyms: 4-acetyl-5-(2-fluorophenyl)-3-hydroxy-1-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1F)C(=O)C)O

STK538970
Synonyms: 6-methyl-2-oxo-1,2-dihydropyridine-3,4-dicarbonitrile
Smiles: Cc1cc(C#N)c(c(=O)[nH]1)C#N

STK538971
Synonyms: 5-(4-butoxyphenyl)-7,9-dichloro-2-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: CCCCOc1ccc(cc1)C1Oc2c(Cl)cc(cc2C2N1N=C(C2)c1ccc(cc1)OC)Cl

STK538972
Synonyms: 7,9-dichloro-5-(4-ethoxyphenyl)-2-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1)C1Oc2c(Cl)cc(cc2C2N1N=C(C2)c1ccc(cc1)OC)Cl

STK538975
Synonyms: 10-acetyl-8-(4-methylphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)C2C(C1=O)C(N1C2C=Cc2c1cccc2)C(=O)C

STK538976
Synonyms: ethyl2-({2-methoxy-5-[(Z)-(1-oxo-3,4-dihydronaphthalen-2(1H)-ylidene)methyl]benzyl}oxy)benzoate
Smiles: CCOC(=O)c1ccccc1OCc1cc(ccc1OC)/C=C\1/CCc2c(C1=O)cccc2

STK538979
Synonyms: (8R,8aR,11aS,11bS)-8-acetyl-10-(4-bromophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: CC(=O)[C@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(cc1)Br

STK538980
Synonyms: 3-amino-N-(4-chlorophenyl)-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(cc1)Cl

STK538981
Synonyms: 2-(4-methoxyphenyl)-N'-(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)acetohydrazide
Smiles: COc1ccc(cc1)CC(=O)NNc1ncnc2c1cnn2c1ccccc1

STK538982
Synonyms: N-(4-methoxyphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)OC)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK538983
Synonyms: 5-hydroxy-11a-(piperidin-1-yl)-6b,7,8,9,10,11a-hexahydro-11H-naphtho[2',1':4,5]furo[2,3-c]azepin-11-one
Smiles: O=C1NCCCC2C1(Oc1c2cc(c2c1cccc2)O)N1CCCCC1

STK538984
Synonyms: ethyl(8S)-6-amino-5,7,7-tricyano-8-(3-methoxy-4-propoxyphenyl)-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCCOc1ccc(cc1OC)[C@@H]1C2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OCC

STK538985
Synonyms: (8R,8aS,11aR,11bR)-8-[(4-bromophenyl)carbonyl]-10-(4-methylphenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1N([C@H]2C(=O)c2ccc(cc2)Br)C=Cc2c1cccc2

STK538987
Synonyms: 5-cyano-2-methyl-N-phenyl-6-sulfanyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(S)NC(=C(C1c1cccs1)C(=O)Nc1ccccc1)C

STK538989
Synonyms: 8-chloro-3-{[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCOc1cc(ccc1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK538990
Synonyms: (8S,8aR,11aS,11bS)-8-acetyl-10-(2-methyl-5-nitrophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: CC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1cc(ccc1C)[N+](=O)[O-]

STK538991
Synonyms: methyl{[4-(4-methylphenyl)-5-oxo-7-(propan-2-yl)-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CC(OC3)C(C)C

STK538992
Synonyms: 2-phenyl-N'-[(1E)-1-phenylbutylidene]quinoline-4-carbohydrazide
Smiles: CCC/C(=N\NC(=O)c1cc(nc2c1cccc2)c1ccccc1)/c1ccccc1

STK538993
Synonyms: (9E)-3-(4-bromophenyl)-9-[4-(difluoromethoxy)benzylidene]-5-[4-(difluoromethoxy)phenyl]-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: FC(Oc1ccc(cc1)/C=C/1\CCCC2=C1N=c1scc(n1C2c1ccc(cc1)OC(F)F)c1ccc(cc1)Br)F

STK538995
Synonyms: (8S,8aR,11aS,11bS)-8-acetyl-10-phenyl-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: O=C1N(c2ccccc2)C(=O)[C@H]2[C@@H]1[C@@H](C(=O)C)N1[C@@H]2c2ccccc2C=C1

STK538996
Synonyms: tert-butyl{[3-cyano-6-phenyl-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetate
Smiles: N#Cc1c(SCC(=O)OC(C)(C)C)nc(cc1c1cccs1)c1ccccc1

STK538997
Synonyms: ethyl6-amino-4-(4-tert-butylphenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(OC(=C(C1c1ccc(cc1)C(C)(C)C)C#N)N)c1ccccc1

STK538998
Synonyms: N'-[(1Z)-1-(4-methoxyphenyl)ethylidene]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: COc1ccc(cc1)/C(=N\NC(=O)CSc1nnc(n1C)c1ccccc1)/C

STK538999
Synonyms: 4-[(E)-{2-[4-(4-methylphenyl)piperazin-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]phenylbenzenesulfonate
Smiles: Cc1ccc(cc1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OS(=O)(=O)c2ccccc2)/S1

STK539000
Synonyms: 3-amino-N-(2,4-dibromophenyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: Brc1ccc(c(c1)Br)NC(=O)c1sc2c(c1N)ccc(n2)c1cccs1

STK539001
Synonyms: 2-{2-methoxy-4-[(E)-{2-[(2-methylquinolin-4-yl)carbonyl]hydrazinylidene}methyl]phenoxy}acetamide
Smiles: COc1cc(/C=N/NC(=O)c2cc(C)nc3c2cccc3)ccc1OCC(=O)N

STK539002
Synonyms: 8-{[cyclohexyl(ethyl)amino]methyl}-3-(3,4-dimethoxyphenyl)-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CCN(C1CCCCC1)Cc1c(O)ccc2c1oc(c(c2=O)c1ccc(c(c1)OC)OC)C(F)(F)F

STK539003
Synonyms: propan-2-yl{[3-cyano-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}acetate
Smiles: N#Cc1c(SCC(=O)OC(C)C)nc(cc1c1ccc(cc1)F)c1cccs1

STK539004
Synonyms: N'-[(E)-(2,4-dichlorophenyl)methylidene]-2-[4-(1H-tetrazol-1-yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)n1cnnn1)N/N=C/c1ccc(cc1Cl)Cl

STK539005
Synonyms: 2-methyl-3-{[(1E)-1-(pyridin-4-yl)ethylidene]amino}quinazolin-4(3H)-one
Smiles: C/C(=N\n1c(C)nc2c(c1=O)cccc2)/c1ccncc1

STK539006
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[4-(dimethylamino)phenyl]methylidene}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(cc1)N(C)C

STK539007
Synonyms: 5-{(E)-[2-(4,6-dimethylpyrimidin-2-yl)hydrazinylidene]methyl}-2-ethoxyphenol
Smiles: CCOc1ccc(cc1O)/C=N/Nc1nc(C)cc(n1)C

STK539009
Synonyms: 8-{[2-(dimethylamino)ethyl]amino}-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN(CCNc1nc2c(n1Cc1ccc(cc1)C)c(=O)n(c(=O)n2C)C)C

STK539010
Synonyms: 1-(4-bromophenyl)-2-[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)oxy]ethanone
Smiles: Brc1ccc(cc1)C(=O)COc1ncnc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STK539011
Synonyms: 6-amino-8-(2-chloro-6-fluorophenyl)-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: CCCN1CC=C2C(C1)C(c1c(F)cccc1Cl)C(C(=C2C#N)N)(C#N)C#N

STK539015
Synonyms: 8-(diethylamino)-7-ethenyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN(c1nc2c(n1C=C)c(=O)[nH]c(=O)n2C)CC

STK539017
Synonyms: methyl3-[({1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetyl)amino]-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cc(c(c2)OC)OC

STK539018
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-cyclohexylideneacetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)NN=C1CCCCC1

STK539021
Synonyms: 2,6,8-trimethyl-3-[(3-methylpiperidin-1-yl)methyl]quinolin-4-ol
Smiles: CC1CCCN(C1)Cc1c(C)nc2c(c1O)cc(cc2C)C

STK539022
Synonyms: ethyl3,3,3-trifluoro-2-(4-{[(3-fluorophenyl)carbonyl](methyl)amino}phenyl)-2-hydroxypropanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(cc1)N(C(=O)c1cccc(c1)F)C)O

STK539023
Synonyms: (6aS,6bR,9aS,10R)-10-[(4-bromophenyl)carbonyl]-8-(2,4-dimethylphenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1C)C)C=Cc1c2cccc1

STK539024
Synonyms: (9E)-3-(4-chlorophenyl)-9-(4-fluorobenzylidene)-5-(4-fluorophenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Fc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)F)/CCC2

STK539025
Synonyms: (4S,4aR)-2-amino-4-(3-ethoxy-4-propoxyphenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: CCCOc1ccc(cc1OCC)[C@@H]1[C@H]2CCCC=C2C(=C(C1(C#N)C#N)N)C#N

STK539026
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(1E)-1-(4-nitrophenyl)ethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C(/c1ccc(cc1)[N+](=O)[O-])\C

STK539027
Synonyms: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-1-(2,6-dimethyl-1H-indol-3-yl)ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCN(CC1)c1cc(Cl)ccc1C)C

STK539028
Synonyms: N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-2-(1H-1,2,4-triazol-1-yl)acetohydrazide
Smiles: O=C(Cn1cncn1)N/N=C/c1ccc(cc1O)O

STK539029
Synonyms: dipropan-2-yl{[4,5-dihydrofuran-3-yl(diphenyl)-lambda~5~-phosphanylidene][(E)-(4-nitrophenyl)diazenyl]methyl}phosphonate
Smiles: CC(OP(=O)(C(=P(c1ccccc1)(c1ccccc1)C1=COCC1)/N=N/c1ccc(cc1)[N+](=O)[O-])OC(C)C)C

STK539030
Synonyms: 3-(4-methoxyphenyl)-2-[(4-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539033
Synonyms: N'-[(Z)-anthracen-9-ylmethylidene]-2-methylquinoline-4-carbohydrazide
Smiles: Cc1nc2ccccc2c(c1)C(=O)N/N=C\c1c2ccccc2cc2c1cccc2

STK539034
Synonyms: 8-(4-benzylpiperazin-1-yl)-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: C=CCn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)Cc1ccccc1

STK539035
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(6-methylpyridin-2-yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cccc(n1)C

STK539037
Synonyms: (1'R,3R,3'R)-3'-(1,3-benzodioxol-5-ylcarbonyl)-1'-[(4-bromophenyl)carbonyl]-7'-chloro-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccc2c(c1)OCO2)Cl

STK539038
Synonyms: 1-(2,6-dimethyl-1H-indol-3-yl)-2-(2-methylpiperidin-1-yl)ethanone
Smiles: Cc1ccc2c(c1)[nH]c(c2C(=O)CN1CCCCC1C)C

STK539039
Synonyms: (6aR,6bS,9aR,10S)-10-acetyl-8-(4-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: O=C1N(c2ccc(cc2)[N+](=O)[O-])C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)C)cccc3

STK539040
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-(2-fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccccc1F

STK539041
Synonyms: 6-amino-4-(4-fluorophenyl)-3-methyl-1-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(cc1)F)c(C)nn2c1ccc(cc1)C

STK539042
Synonyms: 11-(3,4-dichlorophenyl)-2-ethyl-3-(furan-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCc1nc2n(c3ccc(c(c3)Cl)Cl)c3c(c2c(=O)n1Cc1ccco1)nc1c(n3)cccc1

STK539043
Synonyms: 1-[2-(diethylamino)ethyl]-3-hydroxy-5-(4-nitrophenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCN(CCN1C(=O)C(=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)/C=C/c1ccccc1)O)CC

STK539044
Synonyms: 2-(1H-benzimidazol-2-yl)-N'-[(E)-pyridin-3-ylmethylidene]acetohydrazide
Smiles: O=C(Cc1nc2c([nH]1)cccc2)N/N=C/c1cccnc1

STK539045
Synonyms: 3-cyclohexyl-2-[(4-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)CCCCC3

STK539046
Synonyms: ethyl4-hydroxy-2-(4-nitrophenyl)-5-oxo-1-phenyl-2,5-dihydro-1H-pyrrole-3-carboxylate
Smiles: CCOC(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)[N+](=O)[O-])c1ccccc1

STK539048
Synonyms: 3-[(2-methylprop-2-en-1-yl)sulfanyl]-5-(methylsulfanyl)-10-(propan-2-yl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=C)C)nn2)CC(OC3)C(C)C

STK539049
Synonyms: N,N-dicyclohexyl-1,1,1,3,3,4,4,6,6,7,7,9,9,10,10,12,12-heptadecafluoro-2,5,8,11-tetraoxatridecan-13-amide
Smiles: O=C(C(OC(C(OC(C(OC(C(OC(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)N(C1CCCCC1)C1CCCCC1

STK539050
Synonyms: 3-(3-chlorophenyl)-4-phenyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Smiles: Clc1cccc(c1)c1nnc(n1c1ccccc1)SC/C=C/c1ccccc1

STK539051
Synonyms: 9-chloro-2-(4-ethoxyphenyl)-5-[4-(propan-2-yloxy)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1)C1=NN2C(C1)c1cc(Cl)ccc1OC2c1ccc(cc1)OC(C)C

STK539052
Synonyms: 11-(3-methoxyphenyl)-2-methyl-3-(1-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1cccc(c1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)C(c1ccccc1)C

STK539054
Synonyms: 6-amino-4-(3,4-difluorophenyl)-3-methyl-1-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)F)F)c(C)nn2c1ccc(cc1)C

STK539055
Synonyms: 11-(4-butylphenyl)-3-(2-methoxyethyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CCOC

STK539056
Synonyms: 7-[(2Z)-3-chlorobut-2-en-1-yl]-8-(hexylamino)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCNc1nc2c(n1C/C=C(\Cl)/C)c(=O)[nH]c(=O)n2C

STK539057
Synonyms: N'-[(1E)-1-phenylethylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: O=C(N/N=C(/c1ccccc1)\C)CSc1ccccn1

STK539058
Synonyms: 3-amino-6-(3-methoxyphenyl)-N-(2,2,2-trifluoroethyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)NCC(F)(F)F

STK539059
Synonyms: 2-chloro-N'-[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]benzohydrazide
Smiles: Cc1ccc(cc1)n1ncc2c1ncnc2NNC(=O)c1ccccc1Cl

STK539060
Synonyms: N-(4-methylphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539061
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-(3-bromophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1cccc(c1)Br

STK539063
Synonyms: N'-{(E)-[4-(propan-2-yl)phenyl]methylidene}-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1ccc(cc1)C(C)C

STK539064
Synonyms: ethyl2-({(2E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)/C(=C/c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C#N)sc2c1CCCC2

STK539066
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-3-(2-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccccc1n1c(SCc2ccc(cc2)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539067
Synonyms: 2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C)c1ccc(cc1)Cl

STK539068
Synonyms: 2-(1H-benzimidazol-2-yl)-3-hydroxy-2-(4-methoxybenzyl)propanenitrile
Smiles: COc1ccc(cc1)CC(c1nc2c([nH]1)cccc2)(C#N)CO

STK539069
Synonyms: (2E)-N-(2,4-dichlorophenyl)-2-[1-(2,4-dimethoxyphenyl)ethylidene]hydrazinecarbothioamide
Smiles: COc1cc(OC)ccc1/C(=N/NC(=S)Nc1ccc(cc1Cl)Cl)/C

STK539070
Synonyms: 3-methyl-7-(3-phenylpropyl)-8-(propylamino)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCNc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C

STK539071
Synonyms: {[6,6-dimethyl-3-(3-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}aceticacid
Smiles: OC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C

STK539072
Synonyms: 3-amino-N-[4-chloro-3-(trifluoromethyl)phenyl]-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(c(c1)C(F)(F)F)Cl

STK539073
Synonyms: N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)c1ccc(=O)[nH]n1

STK539074
Synonyms: N-(1H-benzimidazol-2-yl)-1-butyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCn1c(=O)c(C(=O)Nc2nc3c([nH]2)cccc3)c(c2c1cccc2)O

STK539075
Synonyms: 2,7-bis(piperidin-1-ylmethyl)-1,8-bis(4-propoxyphenyl)octane-1,8-dione
Smiles: CCCOc1ccc(cc1)C(=O)C(CN1CCCCC1)CCCCC(C(=O)c1ccc(cc1)OCCC)CN1CCCCC1

STK539076
Synonyms: ethyl3-{[(4-chlorophenyl)carbonyl]amino}-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1ccc(cc1)Cl)cc(cc2)OC

STK539078
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2nnc(n2C)c2cccc(c2)Br)ccc1OC

STK539079
Synonyms: 7-ethyl-1,3-dimethyl-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)n(c(=O)n2C)C

STK539081
Synonyms: N'-{(E)-[4-(diethylamino)phenyl]methylidene}-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1)CC

STK539082
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E)-1-phenylethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C(/c1ccccc1)\C

STK539083
Synonyms: 3-(prop-2-en-1-ylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: C=CCSc1nnc2n1cnc1c2c2CCCCc2s1

STK539084
Synonyms: 4-fluoro-N-{3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: CCCCCCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)F)S(=O)(=O)c1ccc(cc1)C

STK539085
Synonyms: (1'R,3R,3'R)-1'-[(3,4-dimethoxyphenyl)carbonyl]-3'-[(4-methoxyphenyl)carbonyl]-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(c(c1)OC)OC)cccc3

STK539086
Synonyms: 2-{[1,1,1,3,3,3-hexafluoro-2-(furan-2-ylamino)propan-2-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)NC(C(F)(F)F)(C(F)(F)F)Nc1ccco1

STK539088
Synonyms: 4-(3-methylphenyl)-1-{[1-(morpholin-4-yl)-1-oxopropan-2-yl]sulfanyl}-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(nnc2n(c1=O)c1cccc(c1)C)SC(C(=O)N1CCOCC1)C)C

STK539089
Synonyms: 2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-phenylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccccc1

STK539090
Synonyms: 2-amino-4-(3,4-difluorophenyl)-6-hexyl-7-hydroxy-4H-chromene-3-carbonitrile
Smiles: CCCCCCc1cc2c(cc1O)OC(=C(C2c1ccc(c(c1)F)F)C#N)N

STK539091
Synonyms: 8-[(2E)-2-benzylidenehydrazinyl]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)Cn1c(N/N=C/c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK539097
Synonyms: 6-{[3-(dimethylamino)propyl]amino}-3,3-dimethyl-8-(2-methylpropyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(NCCCN(C)C)nc(c2c1CC(C)(C)OC2)CC(C)C

STK539098
Synonyms: 4-benzyl-1-(hexylsulfanyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C

STK539099
Synonyms: (2E)-2-(5-bromo-2,4-dimethoxybenzylidene)-N-(2,4-dichlorophenyl)hydrazinecarbothioamide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=S)Nc1ccc(cc1Cl)Cl)Br

STK539100
Synonyms: 7-benzyl-8-[(2E)-2-(2-hydroxy-3-methoxybenzylidene)hydrazinyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cccc(c1O)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK539101
Synonyms: 11-(2-methylpropyl)-7,8,9,10-tetrahydrotetrazolo[1'',5'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)ncn1c3nnn1)C

STK539102
Synonyms: N'-[(1Z)-1-(4-bromophenyl)ethylidene]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C(\c1ccc(cc1)Br)/C

STK539103
Synonyms: 4-[(E)-{2-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]-2-methoxyphenyl(2,4-dioxo-1,3-thiazolidin-5-yl)acetate
Smiles: COc1cc(/C=N/NC(=O)CSc2nc3c(s2)cccc3)ccc1OC(=O)CC1SC(=O)NC1=O

STK539105
Synonyms: 3-amino-N-(3-chlorophenyl)-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1cccc(c1)Cl

STK539106
Synonyms: N,N-dibutyl-2-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetamide
Smiles: CCCCN(C(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)CCCC

STK539107
Synonyms: 8-(cyclohexylmethyl)-9-(heptylsulfanyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1CC1CCCCC1)CCc1c3cccc1

STK539108
Synonyms: 3-(2-methylpropyl)-5-(trifluoromethyl)-4,5-dihydro-1,2-oxazol-5-ol
Smiles: CC(CC1=NOC(C1)(O)C(F)(F)F)C

STK539110
Synonyms: N'-[(1E)-1-(4-methylphenyl)ethylidene]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C(/c1ccc(cc1)C)\C

STK539112
Synonyms: (3aR,4S,9aR,9bS)-4-[(4-bromophenyl)carbonyl]-2-(4-fluorophenyl)-8-(phenylcarbonyl)-3a,4,9a,9b-tetrahydro-1H-pyrrolo[3,4-a]indolizine-1,3(2H)-dione
Smiles: Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccc(cc2)Br)C=CC(=C1)C(=O)c1ccccc1

STK539115
Synonyms: 7-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)heptanamide
Smiles: O=C(NC12CC3CC(C2)CC(C1)C3)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539116
Synonyms: 3-(3-methylphenyl)-2-[(2-phenylethyl)sulfanyl]-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1cccc(c1)C)SCCc1ccccc1)C

STK539117
Synonyms: 8-(benzylsulfanyl)-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: Cc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCc1ccccc1

STK539118
Synonyms: 3,4-dimethoxy-N-{[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl}benzamide
Smiles: COc1cc(ccc1OC)C(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1

STK539119
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1Z)-1-(4-methylphenyl)ethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C(\c1ccc(cc1)C)/C

STK539120
Synonyms: N'-[(E)-(4-methylphenyl)methylidene]-2-phenylquinoline-4-carbohydrazide
Smiles: Cc1ccc(cc1)/C=N/NC(=O)c1cc(nc2c1cccc2)c1ccccc1

STK539121
Synonyms: 2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(1E)-1-phenylpropylidene]acetohydrazide
Smiles: CC/C(=N\NC(=O)CSc1nnc(n1C)c1ccccc1)/c1ccccc1

STK539122
Synonyms: (3-ethoxy-3-oxopropyl)[hydroxy(phenyl)methyl]phosphinicacid
Smiles: CCOC(=O)CCP(=O)(C(c1ccccc1)O)O

STK539125
Synonyms: 2-[(Z)-(1-benzyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-6-iodo-3-phenylquinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C\1/c2ccccc2N(C1=O)Cc1ccccc1)c1ccccc1

STK539127
Synonyms: 2-cyclopropyl-N'-[(E)-(3-phenoxyphenyl)methylidene]quinoline-4-carbohydrazide
Smiles: O=C(c1cc(nc2c1cccc2)C1CC1)N/N=C/c1cccc(c1)Oc1ccccc1

STK539128
Synonyms: 1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCC3

STK539129
Synonyms: (8Z,8'Z)-1,1',6,6'-tetrahydroxy-3,3'-dimethyl-8,8'-bis[({4-[(E)-phenyldiazenyl]phenyl}amino)methylidene]-5,5'-di(propan-2-yl)-2,2'-binaphthalene-7,7'(8H,8'H)-dione
Smiles: CC(C1=C(O)C(=O)/C(=C\Nc2ccc(cc2)/N=N/c2ccccc2)/c2c1cc(C)c(c2O)c1c(C)cc2c(c1O)/C(=C/Nc1ccc(cc1)/N=N/c1ccccc1)/C(=O)C(=C2C(C)C)O)C

STK539131
Synonyms: 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]acetohydrazide
Smiles: COc1cc(cc(c1O)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccccc1)[N+](=O)[O-]

STK539132
Synonyms: N-[4-chloro-2-(phenylcarbonyl)phenyl]-2,2,3,3,4,4,4-heptafluorobutanamide
Smiles: Clc1ccc(c(c1)C(=O)c1ccccc1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

STK539133
Synonyms: 3-{[(E)-(4-ethoxyphenyl)methylidene]amino}-2-(phenoxymethyl)quinazolin-4(3H)-one
Smiles: CCOc1ccc(cc1)/C=N/n1c(COc2ccccc2)nc2c(c1=O)cccc2

STK539134
Synonyms: methyl3-{[(3-methylphenyl)carbonyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)C)cccc2

STK539135
Synonyms: 9-methyl-3,5-bis(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SC)nn2)CCC(C3)C

STK539136
Synonyms: ethyl5-methoxy-3-{[(3-methoxyphenyl)carbonyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)c1cccc(c1)OC)cc(cc2)OC

STK539138
Synonyms: 3-amino-6-methyl-N-(propan-2-yl)-4-(thiophen-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b][1,6]naphthyridine-2-carboxamide
Smiles: CN1CCc2c(C1)c(c1cccs1)c1c(n2)sc(c1N)C(=O)NC(C)C

STK539139
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-phenylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccccc1

STK539140
Synonyms: 2-(3,4-dimethoxyphenyl)-9-nitro-5-[4-(propan-2-yl)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc(cc1OC)C1=NN2C(C1)c1cc(ccc1OC2c1ccc(cc1)C(C)C)[N+](=O)[O-]

STK539141
Synonyms: (5E)-5-(2-butoxybenzylidene)-2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Smiles: CCCCOc1ccccc1/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(c(c1)Cl)C

STK539143
Synonyms: N-(2-methylphenyl)-2-[(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3

STK539146
Synonyms: 4-[(E)-{2-[4-(3-methylphenyl)piperazin-1-yl]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]phenylbenzenesulfonate
Smiles: Cc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)OS(=O)(=O)c2ccccc2)/S1

STK539147
Synonyms: 3-{[(E)-(6-bromo-2-hydroxynaphthalen-1-yl)methylidene]amino}-2-methylquinazolin-4(3H)-one
Smiles: Brc1ccc2c(c1)ccc(c2/C=N/n1c(C)nc2c(c1=O)cccc2)O

STK539149
Synonyms: 2-[7-(4-benzylpiperazin-1-yl)-7-oxoheptyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C(N1CCN(CC1)Cc1ccccc1)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539150
Synonyms: 2-{[3-cyano-6-phenyl-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(3,4-dimethoxyphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(c(c2)OC)OC)nc(cc1c1cccs1)c1ccccc1

STK539151
Synonyms: 3-(3-methylphenyl)-6-(propan-2-yl)-2-(prop-2-en-1-ylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK539152
Synonyms: 2-amino-N-(3,4-dimethylphenyl)-1-[4-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)C(F)(F)F)Nc1ccc(c(c1)C)C

STK539153
Synonyms: 3-(1H-benzimidazol-2-yl)-N'-[(E)-(3,5-dibromo-2-hydroxyphenyl)methylidene]propanehydrazide
Smiles: O=C(CCc1nc2c([nH]1)cccc2)N/N=C/c1cc(Br)cc(c1O)Br

STK539154
Synonyms: N'-[(E)-(3-chlorophenyl)methylidene]-2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccc(c1)Cl

STK539155
Synonyms: 2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-pyridin-2-ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccccn1

STK539156
Synonyms: 9-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8-(prop-2-en-1-yl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)c1CCc3c(c1s2)cccc3

STK539157
Synonyms: 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(S)nc2c1c(=O)n(C)c(=O)n2C)COc1ccccc1C

STK539158
Synonyms: 8-butoxy-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCOc1ncnc2c1sc1c2c2CCCCc2c(n1)CC(C)C

STK539160
Synonyms: 2-(dimethylamino)ethyl1H-indole-3-carboxylate
Smiles: CN(CCOC(=O)c1c[nH]c2c1cccc2)C

STK539162
Synonyms: 8-[benzyl(methyl)amino]-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(Cc1ccccc1)C

STK539163
Synonyms: 2-[(2,6-dichlorobenzyl)sulfanyl]-6-methyl-4-(thiophen-2-yl)-5,6,7,8-tetrahydro-1,6-naphthyridine-3-carbonitrile
Smiles: N#Cc1c(SCc2c(Cl)cccc2Cl)nc2c(c1c1cccs1)CN(CC2)C

STK539165
Synonyms: (2E)-N-(2,4-dichlorophenyl)-2-(3,4-dimethoxybenzylidene)hydrazinecarbothioamide
Smiles: COc1cc(/C=N/NC(=S)Nc2ccc(cc2Cl)Cl)ccc1OC

STK539167
Synonyms: 4-fluoro-N-{3-[(4-methylphenyl)sulfonyl]-1-(1-phenylethyl)-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzenesulfonamide
Smiles: Cc1ccc(cc1)S(=O)(=O)c1c(NS(=O)(=O)c2ccc(cc2)F)n(c2c1nc1ccccc1n2)C(c1ccccc1)C

STK539168
Synonyms: methyl2-{[3-(piperidin-1-yl)quinoxalin-2-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(Nc2nc3ccccc3nc2N2CCCCC2)sc2c1CCCC2

STK539170
Synonyms: 1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-(3-methylphenyl)-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)n2c1cccc(c1)C)CCC3

STK539172
Synonyms: 5-(4-bromophenyl)-1-(4-methylphenyl)-3-[(4-methylphenyl)amino]-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)NC1=CC(N(C1=O)c1ccc(cc1)C)c1ccc(cc1)Br

STK539174
Synonyms: 1,3-dimethyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(N/N=C(\c2ccccc2)/C)nc2c1c(=O)n(c(=O)n2C)C

STK539175
Synonyms: N-(4-methylphenyl)-2-{[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3

STK539176
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-{(E)-[3-methoxy-4-(propan-2-yloxy)phenyl]methylidene}acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cn2nnc(n2)N)ccc1OC(C)C

STK539178
Synonyms: methyl3-{[(4-fluorophenyl)carbonyl]amino}-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccc(cc1)F)cc(cc2)C

STK539179
Synonyms: 9-bromo-5-(2-chlorophenyl)-2-(4-ethoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: CCOc1ccc(cc1)C1=NN2C(C1)c1cc(Br)ccc1OC2c1ccccc1Cl

STK539180
Synonyms: N'-[(E)-(3-methoxy-4-propoxyphenyl)methylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: CCCOc1ccc(cc1OC)/C=N/NC(=O)CSc1ccccn1

STK539181
Synonyms: ethyl2-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}propanoate
Smiles: CCOC(=O)C(Sc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)C

STK539182
Synonyms: (2E)-N-(2,4-dichlorophenyl)-2-{[5-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1cn[nH]c1c1ccc(cc1)F

STK539183
Synonyms: N-{1-butyl-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}naphthalene-2-sulfonamide
Smiles: CCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc2c(c1)cccc2)S(=O)(=O)c1ccc(cc1)C

STK539185
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(5-phenyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cn[nH]c1c1ccccc1

STK539187
Synonyms: 8-[(2Z)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-1,3-dimethyl-7-(4-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)Cn1c(N/N=C/2\C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)n(c(=O)n2C)C

STK539188
Synonyms: (2E)-N-(2,4-dichlorophenyl)-2-[3-methoxy-4-(propan-2-yloxy)benzylidene]hydrazinecarbothioamide
Smiles: COc1cc(/C=N/NC(=S)Nc2ccc(cc2Cl)Cl)ccc1OC(C)C

STK539189
Synonyms: (2E)-N-(2,4-dichlorophenyl)-2-(2-methoxybenzylidene)hydrazinecarbothioamide
Smiles: COc1ccccc1/C=N/NC(=S)Nc1ccc(cc1Cl)Cl

STK539191
Synonyms: 7-ethyl-1,3-dimethyl-8-{(2Z)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(N/N=C(\c2ccc(cc2)[N+](=O)[O-])/C)nc2c1c(=O)n(c(=O)n2C)C

STK539192
Synonyms: 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-[(1E)-1-phenylpropylidene]acetohydrazide
Smiles: CC/C(=N\NC(=O)CSc1nc2c(s1)cccc2)/c1ccccc1

STK539193
Synonyms: 2-cyclopropyl-N'-[(1E)-1-(naphthalen-2-yl)ethylidene]quinoline-4-carbohydrazide
Smiles: C/C(=N\NC(=O)c1cc(nc2c1cccc2)C1CC1)/c1ccc2c(c1)cccc2

STK539194
Synonyms: N,N-bis(4-tert-butylphenyl)furan-2-carboxamide
Smiles: O=C(N(c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)c1ccco1

STK539196
Synonyms: N'-{(E)-[2-(benzyloxy)phenyl]methylidene}-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1ccccc1OCc1ccccc1

STK539197
Synonyms: 2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-phenoxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccc(c1)Oc1ccccc1

STK539198
Synonyms: methyl3-({[4-(3-chlorophenyl)piperazin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)Cl)cc(cc2)C

STK539199
Synonyms: methyl3-{[ethoxy(oxo)acetyl]amino}-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)C(=O)Nc1c([nH]c2c1cc(OC)c(c2)OC)C(=O)OC

STK539205
Synonyms: (8R,8aR)-6-amino-8-(2,5-dimethoxyphenyl)-2-(propan-2-yl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C(C)C)c1cc(OC)ccc1OC)(C#N)C#N

STK539206
Synonyms: 6-hydroxy-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carboxamide
Smiles: O=C(c1c(O)c2cccc3c2n(c1=O)CC3)NCCN1CCOCC1

STK539208
Synonyms: (1'R,3R,3'R)-1'-[(4-bromophenyl)carbonyl]-3'-{[4-(2-methylpropyl)phenyl]carbonyl}-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: CC(Cc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3)C

STK539210
Synonyms: 2-[(2E)-2-(5-bromo-2,4-dimethoxybenzylidene)hydrazinyl]-4,6-dimethylpyrimidine
Smiles: COc1cc(OC)c(cc1/C=N/Nc1nc(C)cc(n1)C)Br

STK539212
Synonyms: 4-(4-ethylpiperazin-1-yl)-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidine
Smiles: CCN1CCN(CC1)c1ncnc2c1c(cs2)c1ccc(cc1)OC

STK539213
Synonyms: methyl3-{[(3-methoxyphenyl)carbonyl]amino}-1H-indole-2-carboxylate
Smiles: COc1cccc(c1)C(=O)Nc1c([nH]c2c1cccc2)C(=O)OC

STK539215
Synonyms: ethyl2-amino-4-{2-[(4-chlorobenzyl)oxy]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: CCOC(=O)C1=C(N)OC2=C(C1c1ccccc1OCc1ccc(cc1)Cl)C(=O)CC(C2)(C)C

STK539216
Synonyms: 2-{4-[(8S)-6-amino-5,7,7-tricyano-2-methyl-1,2,3,7,8,8a-hexahydroisoquinolin-8-yl]-2-methoxyphenoxy}acetamide
Smiles: N#CC1=C(N)C([C@@H](C2C1=CCN(C2)C)c1ccc(c(c1)OC)OCC(=O)N)(C#N)C#N

STK539217
Synonyms: 7-benzyl-2-(benzylsulfanyl)-3-(2-methylphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Cc1ccccc1n1c(SCc2ccccc2)nc2c(c1=O)c1CCN(Cc1s2)Cc1ccccc1

STK539218
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1c(C)nn(c1Cl)c1ccccc1

STK539219
Synonyms: (6aR,6bS,9aR,10S)-10-[(4-bromophenyl)carbonyl]-8-[3-(trifluoromethyl)phenyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@H]1N2[C@@H]([C@@H]3[C@H]1C(=O)N(C3=O)c1cccc(c1)C(F)(F)F)C=Cc1c2cccc1

STK539220
Synonyms: 7-(4-{[(2,4-dichlorophenyl)carbonyl]carbamothioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1ccc(cc1Cl)Cl)c(c2)F

STK539221
Synonyms: N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-phenylquinoline-4-carbohydrazide
Smiles: Cc1nn(c(c1/C=N/NC(=O)c1cc(nc2c1cccc2)c1ccccc1)Cl)c1ccccc1

STK539224
Synonyms: 2-({[4-benzyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)-N-ethylhydrazinecarbothioamide
Smiles: CCNC(=S)NNC(=O)CSc1nnc(n1Cc1ccccc1)c1ccncc1

STK539225
Synonyms: N-phenyl-2-[(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]propanamide
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SC(C(=O)Nc1ccccc1)C

STK539227
Synonyms: (1'R,3R,3'R)-1'-acetyl-3'-[(4-fluorophenyl)carbonyl]-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Fc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)C)cccc3

STK539228
Synonyms: 2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK539229
Synonyms: ethyl[(Z)-2-chloro-2-phenylethenyl][(4-fluorophenyl)(hydroxy)methyl]phosphinate
Smiles: CCOP(=O)(C(c1ccc(cc1)F)O)/C=C(/c1ccccc1)\Cl

STK539230
Synonyms: (6aS,6bR,9aS,10R)-10-acetyl-8-(2-methyl-5-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: O=C1N(c2cc(ccc2C)[N+](=O)[O-])C(=O)[C@H]2[C@@H]1[C@@H]1C=Cc3c(N1[C@H]2C(=O)C)cccc3

STK539231
Synonyms: 3,6-diamino-N-(2-chlorobenzyl)-5-cyanothieno[2,3-b]pyridine-2-carboxamide
Smiles: N#Cc1cc2c(nc1N)sc(c2N)C(=O)NCc1ccccc1Cl

STK539232
Synonyms: 2-[(4-ethylphenyl)(phenyl)methylidene]-1H-indene-1,3(2H)-dione
Smiles: CCc1ccc(cc1)/C(=C/1\C(=O)c2c(C1=O)cccc2)/c1ccccc1

STK539233
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-anthracen-9-ylmethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1c2ccccc2cc2c1cccc2

STK539234
Synonyms: (3E)-3-(morpholin-4-ylimino)-1,3-dihydro-2H-indol-2-one
Smiles: O=C1Nc2c(/C/1=N\N1CCOCC1)cccc2

STK539235
Synonyms: 2-[(2E)-2-(3-bromobenzylidene)hydrazinyl]-4,6-dimethylpyrimidine
Smiles: Brc1cccc(c1)/C=N/Nc1nc(C)cc(n1)C

STK539237
Synonyms: (9E)-9-benzylidene-3-(4-chlorophenyl)-5-phenyl-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Clc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1)CCC/C/3=C\c1ccccc1

STK539238
Synonyms: (2E)-N-(2,4-dichlorophenyl)-2-(4-hydroxybenzylidene)hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccc(cc1)O

STK539239
Synonyms: (3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)aceticacid
Smiles: OC(=O)Cn1cnc2c1c(=O)[nH]c(=O)n2C

STK539240
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2-hydroxy-5-nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1cc(ccc1O)[N+](=O)[O-]

STK539241
Synonyms: (1'R,3R,3'R,3a'S)-1'-[(4-bromophenyl)carbonyl]-3'-[(4-methoxyphenyl)carbonyl]-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1ccc(cc1)C(=O)[C@H]1[C@@H]2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3

STK539242
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-(4-fluorophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccc(cc1)F

STK539244
Synonyms: 7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-3-methyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCc1ccc(cc1)OCC(Cn1c(S)nc2c1c(=O)[nH]c(=O)n2C)O

STK539245
Synonyms: N-(furan-2-ylmethyl)-2-oxo-2H-pyran-5-carboxamide
Smiles: O=c1ccc(co1)C(=O)NCc1ccco1

STK539246
Synonyms: ethyl8-methyl-4-(naphthalen-1-ylamino)quinoline-3-carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc3c1cccc3)cccc2C

STK539247
Synonyms: 6-ethyl-4-imino-2,6-dimethyl-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(6H)-amine
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=N)N)C

STK539249
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-(5-bromo-2,4-dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)Cn1nnc(n1)N)Br

STK539250
Synonyms: N'-[(E)-(3-hydroxyphenyl)methylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide
Smiles: Oc1cccc(c1)/C=N/NC(=O)c1ccc(=O)[nH]n1

STK539251
Synonyms: N'-{(E)-[4-(diethylamino)phenyl]methylidene}-2-(1H-1,2,4-triazol-1-yl)acetohydrazide
Smiles: CCN(c1ccc(cc1)/C=N/NC(=O)Cn1ncnc1)CC

STK539252
Synonyms: 2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-pyridin-3-ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccnc1

STK539253
Synonyms: N'-[(E)-{2-[(4-bromobenzyl)oxy]phenyl}methylidene]-2-cyclopropylquinoline-4-carbohydrazide
Smiles: Brc1ccc(cc1)COc1ccccc1/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK539256
Synonyms: 2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(1E)-1-phenylbutylidene]acetohydrazide
Smiles: CCC/C(=N\NC(=O)CSc1nnc(n1C)c1ccccc1)/c1ccccc1

STK539257
Synonyms: methyl2-[11-(4-ethoxyphenyl)-2-ethyl-4-oxo-4,11-dihydro-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-3-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOc1ccc(cc1)n1c2nc(CC)n(c(=O)c2c2c1nc1ccccc1n2)c1sc2c(c1C(=O)OC)CCCC2

STK539258
Synonyms: 2-[(4-chlorobenzyl)sulfanyl]-3-cyclohexyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Clc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCCCC1)CCCCC3

STK539260
Synonyms: 8-{[2-(diethylamino)ethyl]amino}-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN(CCNc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C)CC

STK539261
Synonyms: (1'R,3R,3'R)-1'-[(4-bromophenyl)carbonyl]-3'-[(4-propylphenyl)carbonyl]-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: CCCc1ccc(cc1)C(=O)[C@H]1C2C=Cc3c(N2[C@H]([C@]21C(=O)Nc1c2cccc1)C(=O)c1ccc(cc1)Br)cccc3

STK539262
Synonyms: N-(2-methylphenyl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539263
Synonyms: 4-(heptyloxy)-2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCCCCOc1nc(C)nc2c1sc1c2cc2c(n1)CC(OC2)(C)C

STK539264
Synonyms: methyl3-({[4-(4-fluorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cc(c(c2)OC)OC

STK539265
Synonyms: 3-[(4-ethylpiperazin-1-yl)methyl]-2,6,8-trimethylquinolin-4-ol
Smiles: CCN1CCN(CC1)Cc1c(C)nc2c(c1O)cc(cc2C)C

STK539266
Synonyms: 7-(2,3-dihydroxypropyl)-3-methyl-8-{(2Z)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCC(Cn1c(N/N=C(\c2ccc(cc2)[N+](=O)[O-])/C)nc2c1c(=O)[nH]c(=O)n2C)O

STK539267
Synonyms: methyl3-[(2-bromohexanoyl)amino]-5-fluoro-1H-indole-2-carboxylate
Smiles: CCCCC(C(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OC)Br

STK539268
Synonyms: 10-methyl-N-(4-methylphenyl)-8-phenyl-11-(thiophen-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1n(nc(c1C2c1cccs1)C)c1ccccc1

STK539269
Synonyms: N'-[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1c(C)nn(c1Cl)c1ccccc1

STK539270
Synonyms: N'-[(E)-{3-[(1,3-benzoxazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}methylidene]-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropanecarbohydrazide
Smiles: COc1ccc(cc1CSc1nc2c(o1)cccc2)/C=N/NC(=O)C1C(C1(C)C)C=C(Cl)Cl

STK539271
Synonyms: 2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-nitrophenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/c1cccc(c1)[N+](=O)[O-]

STK539272
Synonyms: (6aS,6bR,9aS,10R)-10-[(4-methoxyphenyl)carbonyl]-8-(2-methyl-5-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(ccc1C)[N+](=O)[O-])C=Cc1c2cccc1

STK539273
Synonyms: 4-(3-methylphenyl)-7-(propan-2-yl)-1-(prop-2-en-1-ylsulfanyl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CC(OC3)C(C)C

STK539274
Synonyms: 2-[(2E)-2-{2-[(3-bromobenzyl)oxy]benzylidene}hydrazinyl]-4,6-dimethylpyrimidine
Smiles: Brc1cccc(c1)COc1ccccc1/C=N/Nc1nc(C)cc(n1)C

STK539275
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/C=C/c1ccccc1

STK539277
Synonyms: N'-[(E)-anthracen-9-ylmethylidene]-2-[4-(1H-tetrazol-1-yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)n1cnnn1)N/N=C/c1c2ccccc2cc2c1cccc2

STK539278
Synonyms: N-{3-[(4-methylphenyl)sulfonyl]-1-pentyl-1H-pyrrolo[2,3-b]quinoxalin-2-yl}naphthalene-2-sulfonamide
Smiles: CCCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc2c(c1)cccc2)S(=O)(=O)c1ccc(cc1)C

STK539279
Synonyms: 7-ethyl-8-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCn1c(N/N=C/c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK539281
Synonyms: (3E)-3-[2-oxo-2-(4-pentylphenyl)ethylidene]-1,3-dihydro-2H-indol-2-one
Smiles: CCCCCc1ccc(cc1)C(=O)/C=C\1/C(=O)Nc2c1cccc2

STK539282
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-(3-methoxy-4-propoxyphenyl)methylidene]acetohydrazide
Smiles: CCCOc1ccc(cc1OC)/C=N/NC(=O)Cn1nnc(n1)N

STK539283
Synonyms: N-(3-chlorophenyl)-2,2,3,3,4,4,4-heptafluorobutanamide
Smiles: Clc1cccc(c1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

STK539284
Synonyms: (9E)-9-(2-chlorobenzylidene)-5-(2-chlorophenyl)-3-(4-methoxyphenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: COc1ccc(cc1)c1csc2=NC3=C(C(n12)c1ccccc1Cl)CCC/C/3=C\c1ccccc1Cl

STK539285
Synonyms: 3-{[(E)-(4-nitrophenyl)methylidene]amino}-2-propylquinazolin-4(3H)-one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1ccc(cc1)[N+](=O)[O-]

STK539286
Synonyms: (9E)-3-(4-chlorophenyl)-9-(4-methylbenzylidene)-5-(4-methylphenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: Cc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc(cc1)Cl)/C(=C/c1ccc(cc1)C)/CCC2

STK539288
Synonyms: 8-methyl-3,5-dihydro-4H-pyridazino[4,5-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1cn[nH]c(=O)c1[nH]2

STK539290
Synonyms: ethylN-[4-chloro-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]glycinate
Smiles: CCOC(=O)CNc1nc(Cl)nc(n1)N1CCCCC1

STK539291
Synonyms: 2-(2-hydroxyphenyl)-3-methyl-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Smiles: Oc1ccccc1C1Nc2sc3c(c2C(=O)N1C)CCCC3

STK539293
Synonyms: 7-hexyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(NCc2ccc(cc2)C)nc2c1c(=O)[nH]c(=O)n2C

STK539295
Synonyms: 2-[(2E)-2-(2,4-dichlorobenzylidene)hydrazinyl]-4,6-dimethylpyrimidine
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1nc(C)cc(n1)C

STK539297
Synonyms: ethyl3-[(2-bromo-3-methylbutanoyl)amino]-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)C(C(C)C)Br)cc(cc2)OC

STK539298
Synonyms: 6-amino-4-(3-methoxyphenyl)-3-methyl-1-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: COc1cccc(c1)C1C(=C(N)Oc2c1c(C)nn2c1ccc(cc1)C)C#N

STK539299
Synonyms: N'-{(E)-[4-(dimethylamino)phenyl]methylidene}-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: CN(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1)C

STK539300
Synonyms: 2-[(2E)-2-{2-[(4-chlorobenzyl)oxy]benzylidene}hydrazinyl]-4,6-dimethylpyrimidine
Smiles: Clc1ccc(cc1)COc1ccccc1/C=N/Nc1nc(C)cc(n1)C

STK539301
Synonyms: 4-[6-(4-fluorophenoxy)hexyl]thiomorpholine
Smiles: Fc1ccc(cc1)OCCCCCCN1CCSCC1

STK539302
Synonyms: (6aS,6bR,9aS,10R)-10-[(4-bromophenyl)carbonyl]-3-chloro-8-(2-methyl-5-nitrophenyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cc(ccc1C)[N+](=O)[O-])C=Cc1c2ccc(c1)Cl

STK539303
Synonyms: 3-benzyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(=C)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C

STK539304
Synonyms: N'-[(E)-(4-chlorophenyl)methylidene]-2-cyclopropylquinoline-4-carbohydrazide
Smiles: Clc1ccc(cc1)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK539305
Synonyms: 3-{[(E)-(3-nitrophenyl)methylidene]amino}-2-propylquinazolin-4(3H)-one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C/c1cccc(c1)[N+](=O)[O-]

STK539306
Synonyms: 3-(furan-2-ylmethyl)-11-(4-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: Cc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)Cc1ccco1

STK539308
Synonyms: 2-{[4-benzyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,3-dimethoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1OC)/C=N/NC(=O)CSc1nnc(n1Cc1ccccc1)c1ccncc1

STK539309
Synonyms: pentyl{[3-(3-methylphenyl)-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK539310
Synonyms: 6-[3-({4,6-bis[(2,4-dimethylphenyl)amino]-1,3,5-triazin-2-yl}sulfanyl)-4H-1,2,4-triazol-4-yl]-N,N'-bis(2,4-dimethylphenyl)-1,3,5-triazine-2,4-diamine
Smiles: Cc1ccc(c(c1)C)Nc1nc(nc(n1)Sc1nncn1c1nc(nc(n1)Nc1ccc(cc1C)C)Nc1ccc(cc1C)C)Nc1ccc(cc1C)C

STK539312
Synonyms: ethyl4-{[(3,5-dinitrophenyl)carbonyl]amino}-3-ethyl-2-thioxo-2,3-dihydro-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(=S)n(c1NC(=O)c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CC

STK539313
Synonyms: 3-{[7-chloro-3-(ethoxycarbonyl)-8-methylquinolin-4-yl]amino}benzoicacid
Smiles: CCOC(=O)c1cnc2c(c1Nc1cccc(c1)C(=O)O)ccc(c2C)Cl

STK539314
Synonyms: tert-butyl(8S,8aR)-6-amino-5,7,7-tricyano-8-[3-ethoxy-4-(propan-2-yloxy)phenyl]-3,7,8,8a-tetrahydroisoquinoline-2(1H)-carboxylate
Smiles: CCOc1cc(ccc1OC(C)C)[C@@H]1[C@H]2CN(CC=C2C(=C(C1(C#N)C#N)N)C#N)C(=O)OC(C)(C)C

STK539315
Synonyms: N'-[(1E)-1-(2,4-dimethoxyphenyl)ethylidene]-2-(1H-1,2,4-triazol-1-yl)acetohydrazide
Smiles: COc1cc(OC)ccc1/C(=N/NC(=O)Cn1cncn1)/C

STK539316
Synonyms: methyl3-({[4-(3-chlorophenyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)Cl)cc(c(c2)OC)OC

STK539317
Synonyms: N-(4-chlorophenyl)-2-{[5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetamide
Smiles: CC(Cc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)Nc1ccc(cc1)Cl)C

STK539318
Synonyms: 5-(morpholin-4-yl)-8-[(2-phenoxyethyl)sulfanyl]-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: O1CCN(CC1)c1nc2sc3c(c2c2c1CCCC2)ncnc3SCCOc1ccccc1

STK539320
Synonyms: 2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3

STK539321
Synonyms: 2-[7-(4-methylpiperazin-1-yl)-7-oxoheptyl]-1H-isoindole-1,3(2H)-dione
Smiles: CN1CCN(CC1)C(=O)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539322
Synonyms: N'-[(E)-{4-[(3,4-dichlorobenzyl)oxy]-3-methoxyphenyl}methylidene]-2-methylquinoline-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2cc(C)nc3c2cccc3)ccc1OCc1ccc(c(c1)Cl)Cl

STK539323
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(5-nitrothiophen-2-yl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(s1)[N+](=O)[O-]

STK539324
Synonyms: (E)-N-{[8,9-bis(4-methoxyphenyl)furo[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-phenylmethanimine
Smiles: COc1ccc(cc1)c1c(oc2c1c1nc(nn1cn2)CO/N=C/c1ccccc1)c1ccc(cc1)OC

STK539326
Synonyms: (7E)-N-methyl-7-(methylimino)cyclohepta-1,3,5-trien-1-amine
Smiles: C/N=c/1\cccccc1NC

STK539327
Synonyms: 4-[3-acetyl-4-hydroxy-2-(3-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoicacid
Smiles: OC(=O)CCCN1C(c2cccc(c2)[N+](=O)[O-])C(=C(C1=O)O)C(=O)C

STK539328
Synonyms: N-(3-acetylphenyl)-2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoroheptanamide
Smiles: O=C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Nc1cccc(c1)C(=O)C

STK539329
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-{2-[(4-chlorobenzyl)oxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccccc1OCc1ccc(cc1)Cl

STK539330
Synonyms: 2-[(2,4-dichlorobenzyl)sulfanyl]-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2Cl)Cl)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

STK539331
Synonyms: (8R,8aR,11aS,11bS)-8-acetyl-10-(3-fluorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Smiles: Fc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@H]2C(=O)C)C=Cc2c1cccc2

STK539332
Synonyms: 3-(furan-2-ylmethyl)-11-(3-methoxyphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1cccc(c1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)Cc1ccco1

STK539333
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1cccc(c1O)/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br

STK539334
Synonyms: (6aR,6bS,9aR,10S)-8-(2-methoxyphenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1[C@@H]2C=Cc2c1cccc2)C(=O)c1ccccc1

STK539335
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(cc1)O

STK539336
Synonyms: 1-ethyl-6-fluoro-7-(4-octanoylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCCCCCCC(=O)N1CCN(CC1)c1cc2n(CC)cc(c(=O)c2cc1F)C(=O)O

STK539337
Synonyms: methyl3-{[2-(4-benzylpiperidin-1-yl)propanoyl]amino}-5-chloro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)C(N1CCC(CC1)Cc1ccccc1)C)cc(cc2)Cl

STK539338
Synonyms: (8R,8aR)-6-amino-8-(2,3-dimethoxyphenyl)-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCNC2)c1cccc(c1OC)OC)(C#N)C#N

STK539339
Synonyms: N'-[(E)-(3-methoxyphenyl)methylidene]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1

STK539340
Synonyms: N'-[(E)-(2-chlorophenyl)methylidene]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1ccccc1Cl

STK539342
Synonyms: methyl2-{[(pyridin-3-ylcarbonyl)carbamothioyl]amino}-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)c2cccnc2)sc2c1CCCCCCCCCC2

STK539343
Synonyms: (5E)-2-[4-(3-chloro-4-methylphenyl)piperazin-1-yl]-5-(4-propoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: CCCOc1ccc(cc1)/C=C\1/SC(=NC1=O)N1CCN(CC1)c1ccc(c(c1)Cl)C

STK539344
Synonyms: 8-{(2E)-2-[(2E)-2-bromo-3-phenylprop-2-en-1-ylidene]hydrazinyl}-1,3-dimethyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(N/N=C/C(=C\c2ccccc2)/Br)nc2c1c(=O)n(c(=O)n2C)C

STK539345
Synonyms: N'-[(E)-(3-{[4-chloro-5-methyl-2-(propan-2-yl)phenoxy]methyl}-4-methoxyphenyl)methylidene]-6-oxo-1,6-dihydropyridazine-3-carbohydrazide
Smiles: COc1ccc(cc1COc1cc(C)c(cc1C(C)C)Cl)/C=N/NC(=O)c1ccc(=O)[nH]n1

STK539347
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(Z)-{2-[(4-nitrobenzyl)oxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C\c1ccccc1OCc1ccc(cc1)[N+](=O)[O-]

STK539348
Synonyms: N-(3,4-dichlorophenyl)-10-methyl-8-phenyl-11-(thiophen-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Smiles: Cc1nn(c2c1C(c1cccs1)n1c(=N2)c(Nc2ccc(c(c2)Cl)Cl)nc2c1cccc2)c1ccccc1

STK539349
Synonyms: (9E)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-9-(4-ethoxybenzylidene)-5-(4-ethoxyphenyl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: CCOc1ccc(cc1)C1C2=C(N=c3n1c(cs3)c1ccc3c(c1)OCCO3)/C(=C/c1ccc(cc1)OCC)/CCC2

STK539350
Synonyms: (8S,8aR)-6-amino-8-(3-bromo-4-methoxyphenyl)-2-methyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCN(C2)C)c1ccc(c(c1)Br)OC)(C#N)C#N

STK539351
Synonyms: 11-(propan-2-yl)-3-(prop-2-en-1-ylsulfanyl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: C=CCSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)C(C)C

STK539353
Synonyms: (9E)-3-(4-chlorophenyl)-9-[4-(difluoromethoxy)benzylidene]-5-[4-(difluoromethoxy)phenyl]-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline
Smiles: FC(Oc1ccc(cc1)/C=C/1\CCCC2=C1N=c1scc(n1C2c1ccc(cc1)OC(F)F)c1ccc(cc1)Cl)F

STK539354
Synonyms: 2'-imino-2-oxohexahydro-2'H-spiro[cyclohexane-1,4'-[1]oxa[3,9a]methano[1]benzoxepine]-3',10',10'-tricarbonitrile
Smiles: N#CC1(C#N)C23CCCCC3CC3(C1(C#N)C(=N)O2)CCCCC3=O

STK539356
Synonyms: 6-{[2-(diethylamino)ethyl]amino}-3,3-dimethyl-8-(2-methylpropyl)-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: CCN(CCNc1nc(CC(C)C)c2c(c1C#N)CC(OC2)(C)C)CC

STK539357
Synonyms: 5-(4-fluorophenyl)-3-hydroxy-1-(4-methoxyphenyl)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)c1ccccc1)O

STK539358
Synonyms: 2-{[3-benzyl-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C

STK539359
Synonyms: 1-(2,6-dimethyl-1H-indol-3-yl)-2-[(3R)-4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]ethanone
Smiles: COc1cccc(c1)N1CCN(CC1C)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539360
Synonyms: methyl3-{[(2-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cccc2

STK539361
Synonyms: 3-(2-chloro-1H-benzimidazol-1-yl)propanenitrile
Smiles: N#CCCn1c(Cl)nc2c1cccc2

STK539362
Synonyms: N'-(4,6-dimethyl-2-{[4-(pyrimidin-2-yl)piperazin-1-yl]carbonyl}thieno[2,3-b]pyridin-3-yl)-N,N-dimethylimidoformamide
Smiles: CN(/C=N/c1c(sc2c1c(C)cc(n2)C)C(=O)N1CCN(CC1)c1ncccn1)C

STK539365
Synonyms: N-(furan-2-ylmethyl)-N'-(5-propyl-1,3,4-thiadiazol-2-yl)ethanediamide
Smiles: CCCc1nnc(s1)NC(=O)C(=O)NCc1ccco1

STK539367
Synonyms: 2-(heptylsulfanyl)-3-(3-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK539368
Synonyms: 8-{(2E)-2-[(2Z)-2-chloro-3-(4-nitrophenyl)prop-2-en-1-ylidene]hydrazinyl}-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(N/N=C/C(=C/c2ccc(cc2)[N+](=O)[O-])/Cl)nc2c1c(=O)n(c(=O)n2C)C)COc1ccccc1C

STK539369
Synonyms: 2-cyclopropyl-N'-[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]quinoline-4-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2cc(nc3c2cccc3)C2CC2)ccc1O

STK539370
Synonyms: 2-propyl-3-{[(1E)-1-(pyridin-4-yl)ethylidene]amino}quinazolin-4(3H)-one
Smiles: CCCc1nc2ccccc2c(=O)n1/N=C(/c1ccncc1)\C

STK539371
Synonyms: ethyl{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}(phenyl)acetate
Smiles: CCOC(=O)C(c1ccccc1)Sc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK539373
Synonyms: N'-[(E)-anthracen-9-ylmethylidene]-2-cyclopropylquinoline-4-carbohydrazide
Smiles: O=C(c1cc(nc2c1cccc2)C1CC1)N/N=C/c1c2ccccc2cc2c1cccc2

STK539376
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-(4-methoxyphenyl)methylidene]acetohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)Cn1nnc(n1)N

STK539377
Synonyms: 8-chloro-2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: Clc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccccc1

STK539378
Synonyms: N'-[(E)-(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-2-(1H-1,2,4-triazol-1-yl)acetohydrazide
Smiles: COc1cc(cc(c1O)/C=N/NC(=O)Cn1cncn1)[N+](=O)[O-]

STK539379
Synonyms: 3-(3-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(=C)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)C(C)C

STK539380
Synonyms: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-1-(8-methyl-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)ethanone
Smiles: Clc1ccc(c(c1)N1CCN(CC1)CC(=O)N1CCc2c(C1)c1cc(C)ccc1[nH]2)C

STK539381
Synonyms: 3-(4-bromophenyl)-2-pentylquinazolin-4(3H)-one
Smiles: CCCCCc1nc2ccccc2c(=O)n1c1ccc(cc1)Br

STK539382
Synonyms: 4-(4-methoxyphenyl)-3-methyl-1-phenyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one
Smiles: COc1ccc(cc1)C1SCC(=O)Nc2c1c(C)nn2c1ccccc1

STK539383
Synonyms: 3-{[(E)-(2-hydroxynaphthalen-1-yl)methylidene]amino}-2-[(2-methylphenoxy)methyl]quinazolin-4(3H)-one
Smiles: Cc1ccccc1OCc1nc2ccccc2c(=O)n1/N=C/c1c(O)ccc2c1cccc2

STK539384
Synonyms: 2-(1,3-benzothiazol-2-ylsulfanyl)-N'-[(E)-{2-[(4-nitrobenzyl)oxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(CSc1nc2c(s1)cccc2)N/N=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-]

STK539385
Synonyms: (2E)-N-(2,4-dichlorophenyl)-2-[4-(dimethylamino)benzylidene]hydrazinecarbothioamide
Smiles: S=C(Nc1ccc(cc1Cl)Cl)N/N=C/c1ccc(cc1)N(C)C

STK539386
Synonyms: (8S,8aR)-6-amino-8-(4-tert-butylphenyl)-2-propyl-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: CCCN1CC=C2[C@H](C1)[C@@H](c1ccc(cc1)C(C)(C)C)C(C(=C2C#N)N)(C#N)C#N

STK539388
Synonyms: N-benzyl-2-{[4-(4-methoxyphenyl)-5-oxo-7-(propan-2-yl)-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}propanamide
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CC(OCc1s2)C(C)C)SC(C(=O)NCc1ccccc1)C

STK539389
Synonyms: methyl4-(4-methylphenyl)-2-{[(thiophen-2-ylacetyl)carbamothioyl]amino}thiophene-3-carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(cc1)C)NC(=S)NC(=O)Cc1cccs1

STK539390
Synonyms: 2-(2-bromophenyl)-3-phenylquinazolin-4(3H)-one
Smiles: Brc1ccccc1c1nc2ccccc2c(=O)n1c1ccccc1

STK539392
Synonyms: N'-[(E)-(2-methoxyphenyl)methylidene]-2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetohydrazide
Smiles: COc1ccccc1/C=N/NC(=O)CSc1nnc(n1C)c1ccccc1

STK539393
Synonyms: methyl5-bromo-3-{[(4-chlorophenyl)carbonyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccc(cc1)Cl)cc(cc2)Br

STK539394
Synonyms: pentyl{[3-benzyl-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C

STK539396
Synonyms: methyl2-{[(2-amino-1-hexyl-1H-pyrrolo[2,3-b]quinoxalin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCCCCCn1c2nc3ccccc3nc2c(c1N)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

STK539397
Synonyms: N-({2-[(2-phenylquinolin-4-yl)carbonyl]hydrazinyl}carbonothioyl)furan-2-carboxamide
Smiles: S=C(NC(=O)c1ccco1)NNC(=O)c1cc(nc2c1cccc2)c1ccccc1

STK539398
Synonyms: 2-({[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Smiles: COc1ccc(cc1OC)/C=C/C(=O)NC(=S)Nc1sc2c(c1C(=O)N)CCCCCC2

STK539399
Synonyms: diethyl(tert-butylamino)(formylamino)propanedioate
Smiles: O=CNC(C(=O)OCC)(C(=O)OCC)NC(C)(C)C

STK539400
Synonyms: 2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK539403
Synonyms: 5-cyano-6-{[2-(cyclopropylamino)-2-oxoethyl]sulfanyl}-2-methyl-N-phenyl-1,4-dihydro-4,4'-bipyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)NC2CC2)NC(=C(C1c1ccncc1)C(=O)Nc1ccccc1)C

STK539404
Synonyms: 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(2Z,3E)-4-phenylbut-3-en-2-ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1c1ccccc1)c1ccccc1)N/N=C(\C=C\c1ccccc1)/C

STK539406
Synonyms: 2-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1CC(=C)C)CCCCC3

STK539408
Synonyms: 2-(5-amino-1H-tetrazol-1-yl)-N'-[(E)-(3,5-dibromo-4-hydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnnc1N)N/N=C/c1cc(Br)c(c(c1)Br)O

STK539410
Synonyms: methyl2-({[2-amino-1-(3-chlorophenyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1cccc(c1)Cl

STK539412
Synonyms: 2,2,5-trimethyl-8-(propylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK539413
Synonyms: 3-{[(E)-(3-nitrophenyl)methylidene]amino}-2-[({[(1E)-1-phenylethylidene]amino}oxy)methyl]quinazolin-4(3H)-one
Smiles: C/C(=N\OCc1nc2ccccc2c(=O)n1/N=C/c1cccc(c1)[N+](=O)[O-])/c1ccccc1

STK539414
Synonyms: 2-amino-4-(2-fluoro-5-methoxyphenyl)-5-oxo-4H,5H-pyrano[3,2-c]chromene-3-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc(OC)ccc1F)c(=O)oc1c2cccc1

STK539415
Synonyms: 4-benzyl-1-[(2-methylprop-2-en-1-yl)sulfanyl]-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C

STK539416
Synonyms: 3-(4-{[5-(3,4-dichlorophenyl)furan-2-yl]carbonothioyl}piperazin-1-yl)propanenitrile
Smiles: N#CCCN1CCN(CC1)C(=S)c1ccc(o1)c1ccc(c(c1)Cl)Cl

STK539417
Synonyms: 3-{[(E)-(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]amino}-2-methylquinazolin-4(3H)-one
Smiles: Brc1cc(/C=N/n2c(C)nc3c(c2=O)cccc3)c(c(c1)[N+](=O)[O-])O

STK539418
Synonyms: methylN-[(2,5-dichlorophenyl)carbamoyl]-3,3,3-trifluoro-2-(3-fluorophenoxy)alaninate
Smiles: COC(=O)C(C(F)(F)F)(Oc1cccc(c1)F)NC(=O)Nc1cc(Cl)ccc1Cl

STK539419
Synonyms: 3-cyclohexyl-11-(2-methoxybenzyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: COc1ccccc1Cn1c2nc3ccccc3nc2c2c1ncn(c2=O)C1CCCCC1

STK539420
Synonyms: 8-{[2-(diethylamino)ethyl]amino}-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCN(CCNc1nc2c(n1CC(COc1ccc(cc1)OC)O)c(=O)n(c(=O)n2C)C)CC

STK539422
Synonyms: 3-benzyl-2-[(4-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1ccc(cc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3

STK539423
Synonyms: 6-[3-acetyl-4-hydroxy-2-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)C

STK539424
Synonyms: 5-amino-2-(3-nitrophenyl)-1-phenyl-1,2-dihydro-3H-pyrrole-3,3,4-tricarbonitrile
Smiles: N#CC1=C(N)N(C(C1(C#N)C#N)c1cccc(c1)[N+](=O)[O-])c1ccccc1

STK539425
Synonyms: (8S)-6-amino-2-ethyl-8-[3-methoxy-4-(propan-2-yloxy)phenyl]-2,3,8,8a-tetrahydroisoquinoline-5,7,7(1H)-tricarbonitrile
Smiles: CCN1CC=C2C(C1)[C@@H](c1ccc(c(c1)OC)OC(C)C)C(C(=C2C#N)N)(C#N)C#N

STK539426
Synonyms: 1-(3,4-dichlorophenyl)-3-(2-hydroxy-2-methylpropyl)urea
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)NCC(O)(C)C

STK539427
Synonyms: ethyl{[3-(2-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2ccccc2c(=O)n1c1ccccc1OC

STK539429
Synonyms: (1R,9R)-1,9-bis(2-fluorophenyl)-2,5,8-trimethyl-2,3,4,5,6,7,8,9-octahydro-1H-pyrrolo[3,2-c:4,5-c']dipyridine
Smiles: CN1CCc2c([C@@H]1c1ccccc1F)c1c(n2C)CCN([C@H]1c1ccccc1F)C

STK539430
Synonyms: 2-cyclopropyl-N'-[(E)-(3,5-dibromo-4-hydroxyphenyl)methylidene]quinoline-4-carbohydrazide
Smiles: Brc1cc(/C=N/NC(=O)c2cc(nc3c2cccc3)C2CC2)cc(c1O)Br

STK539431
Synonyms: (1'R,3R,3'R)-1'-[(3,4-dimethoxyphenyl)carbonyl]-3'-(phenylcarbonyl)-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: COc1cc(ccc1OC)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1ccccc1

STK539432
Synonyms: ethyl1-{[(E)-ethoxymethylidene]amino}-5-(2-methylpropyl)-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate
Smiles: CCOC(=O)c1sc2c(c1/N=C/OCC)c1CCCCc1c(n2)CC(C)C

STK539433
Synonyms: 3-[(2-bromoprop-2-en-1-yl)sulfanyl]-5-(methylsulfanyl)-10-(propan-2-yl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCC(=C)Br)nn2)CC(OC3)C(C)C

STK539434
Synonyms: 2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1cccc(c1)Br)N/N=C/c1ccc(cc1O)O

STK539435
Synonyms: methyl4,5-dimethyl-2-({3-[(phenylsulfonyl)amino]quinoxalin-2-yl}amino)thiophene-3-carboxylate
Smiles: COC(=O)c1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccccc2)sc(c1C)C

STK539437
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-1,3-benzodioxol-5-ylmethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccc2c(c1)OCO2

STK539438
Synonyms: 9-(heptylsulfanyl)-8-phenyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCc1c3cccc1

STK539441
Synonyms: 2-cyclopropyl-N'-[(E)-(4-ethoxy-3-hydroxyphenyl)methylidene]quinoline-4-carbohydrazide
Smiles: CCOc1ccc(cc1O)/C=N/NC(=O)c1cc(nc2c1cccc2)C1CC1

STK539442
Synonyms: 8-{[2-(dimethylamino)ethyl]amino}-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)OCC(Cn1c(NCCN(C)C)nc2c1c(=O)[nH]c(=O)n2C)O

STK539443
Synonyms: 2-{[5-(4-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccc(cc1)Cl)N/N=C/C=C/c1ccccc1

STK539446
Synonyms: 4,6-dimethyl-2-phenoxypyridine-3-carbonitrile
Smiles: N#Cc1c(C)cc(nc1Oc1ccccc1)C

STK539447
Synonyms: 1-(2,6-dimethyl-1H-indol-3-yl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone
Smiles: COc1ccccc1N1CCN(CC1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539448
Synonyms: N-(3,4-dimethylphenyl)-2-(8-methoxy-2-methyl-4-oxoquinolin-1(4H)-yl)acetamide
Smiles: COc1cccc2c1n(CC(=O)Nc1ccc(c(c1)C)C)c(cc2=O)C

STK539450
Synonyms: N'-[(E)-pyridin-3-ylmethylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C/c1cccnc1

STK539451
Synonyms: N'-[(E)-(5-bromo-2,4-dimethoxyphenyl)methylidene]-2-{[5-(3-bromophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Smiles: COc1cc(OC)c(cc1/C=N/NC(=O)CSc1nnc(n1C)c1cccc(c1)Br)Br

STK539452
Synonyms: 4,6-dimethyl-2-{(2E)-2-[1-(4-methylphenyl)ethylidene]hydrazinyl}pyrimidine
Smiles: Cc1ccc(cc1)/C(=N/Nc1nc(C)cc(n1)C)/C

STK539456
Synonyms: 1-methyl-4-(3-methylphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1cccc(c1)n1c(=O)c2c3CCCc3sc2n2c1nnc2C

STK539458
Synonyms: N-benzyl-3-chloro-N-[cyano(phenyl)methyl]propanamide
Smiles: ClCCC(=O)N(C(c1ccccc1)C#N)Cc1ccccc1

STK539459
Synonyms: ethyl5-fluoro-3-({2-[4-(2-hydroxyethyl)piperazin-1-yl]propanoyl}amino)-1H-indole-2-carboxylate
Smiles: OCCN1CCN(CC1)C(C(=O)Nc1c([nH]c2c1cc(F)cc2)C(=O)OCC)C

STK539460
Synonyms: methyl3-({[4-(3-chlorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)Cl)cccc2

STK539461
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-(2,4-dichlorophenyl)methylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1ccc(cc1Cl)Cl

STK539462
Synonyms: 2-cyclopropyl-N'-[(E)-naphthalen-1-ylmethylidene]quinoline-4-carbohydrazide
Smiles: O=C(c1cc(nc2c1cccc2)C1CC1)N/N=C/c1cccc2c1cccc2

STK539464
Synonyms: 7-[(3-methoxypropyl)amino]-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: COCCCNc1cc2oc3ccccc3[nH]c2c2c1c(=O)c1ccccc1c2=O

STK539465
Synonyms: 2-(2,6-dichlorophenyl)-4,5-diphenyl-1H-imidazole
Smiles: Clc1cccc(c1c1nc(c([nH]1)c1ccccc1)c1ccccc1)Cl

STK539466
Synonyms: 2-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-7-methoxy-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1cccc2c1OC(c1ccc(c(c1)OC)OC)N1C2CC(=N1)c1ccc(cc1)Cl

STK539467
Synonyms: 2-[4-(prop-2-en-1-yloxy)phenyl]-5-(thiophen-2-yl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: C=CCOc1ccc(cc1)C1=NN2C(C1)c1ccccc1OC2c1cccs1

STK539469
Synonyms: 1-(2,6-dimethyl-1H-indol-3-yl)-2-(3-methylpiperidin-1-yl)ethanone
Smiles: CC1CCCN(C1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539470
Synonyms: 3-{[(E)-(2,4-dihydroxyphenyl)methylidene]amino}-2-[(2-methylphenoxy)methyl]quinazolin-4(3H)-one
Smiles: Oc1ccc(c(c1)O)/C=N/n1c(COc2ccccc2C)nc2c(c1=O)cccc2

STK539472
Synonyms: methyl2-({[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]carbamothioyl}amino)-4-(4-methylphenyl)thiophene-3-carboxylate
Smiles: COC(=O)c1c(scc1c1ccc(cc1)C)NC(=S)NC(=O)/C=C/c1ccc(c(c1)OC)OC

STK539474
Synonyms: 2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methyl-1H-indol-3-yl)ethanone
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)c1c(C)[nH]c2c1cccc2

STK539475
Synonyms: methyl4-[(E)-{2-[(2-methylimidazo[1,2-a]pyridin-3-yl)carbonyl]hydrazinylidene}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1c(C)nc2n1cccc2

STK539476
Synonyms: 8-chloro-3-{[(E)-(4-hydroxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Oc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl

STK539477
Synonyms: 3-amino-N-(3,5-dimethoxybenzyl)-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cc(CNC(=O)c2sc3c(c2N)ccc(n3)c2cccs2)cc(c1)OC

STK539478
Synonyms: 3-({(E)-[4-(decyloxy)phenyl]methylidene}amino)-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC

STK539479
Synonyms: N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)CSc2ccccn2)cc(c1O)Br

STK539481
Synonyms: 3-({3-methyl-2-[(phenylcarbonyl)amino]but-2-enoyl}amino)benzoicacid
Smiles: CC(=C(C(=O)Nc1cccc(c1)C(=O)O)NC(=O)c1ccccc1)C

STK539482
Synonyms: 3-amino-N-(2,3-dimethylphenyl)-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1cccc(c1C)C

STK539483
Synonyms: pentyl{[6,6-dimethyl-3-(3-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C

STK539485
Synonyms: 1-ethyl-6-fluoro-4-oxo-N-(pyridin-4-ylmethyl)-7-[4-(quinolin-2-ylcarbonyl)piperazin-1-yl]-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)NCc2ccncc2)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccc3c(n1)cccc3)c(c2)F

STK539486
Synonyms: N'-[(E)-(5-nitrothiophen-2-yl)methylidene]-2-[4-(1H-tetrazol-1-yl)phenoxy]acetohydrazide
Smiles: O=C(COc1ccc(cc1)n1cnnn1)N/N=C/c1ccc(s1)[N+](=O)[O-]

STK539488
Synonyms: N'-[(2E,3E)-4-phenylbut-3-en-2-ylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C(/C=C/c1ccccc1)\C

STK539489
Synonyms: 2,2,5-trimethyl-8-[(2-phenylethyl)sulfanyl]-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: Cc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCCc1ccccc1

STK539490
Synonyms: 2-[(E)-(4-bromophenyl)diazenyl]-2-[3,4-dihydro-2H-pyran-5-yl(diphenyl)-lambda~5~-phosphanylidene]-1-phenylethanone
Smiles: Brc1ccc(cc1)/N=N/C(=P(c1ccccc1)(c1ccccc1)C1=COCCC1)C(=O)c1ccccc1

STK539491
Synonyms: ethyl6-tert-butyl-1,4-diphenyl-1,4-dihydro-1,2,4-diazaphosphinine-3-carboxylate4-sulfide
Smiles: CCOC(=O)C1=NN(c2ccccc2)C(=CP1(=S)c1ccccc1)C(C)(C)C

STK539492
Synonyms: [3-amino-4-(4-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridin-2-yl](3-methoxyphenyl)methanone
Smiles: COc1cccc(c1)C(=O)c1sc2c(c1N)c(c1ccc(cc1)Cl)c1c(n2)CCC1

STK539493
Synonyms: 2-[(4-methyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-[(E)-pyridin-3-ylmethylidene]acetohydrazide
Smiles: O=C(CSc1nnc(n1C)c1ccccc1)N/N=C/c1cccnc1

STK539494
Synonyms: 3-bromo-N-(5-chloropyridin-2-yl)-2-oxo-2H-pyran-5-carboxamide
Smiles: Clc1ccc(nc1)NC(=O)c1coc(=O)c(c1)Br

STK539496
Synonyms: (1S)-N-(4-fluorophenyl)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinoline-2(1H)-carbothioamide
Smiles: COc1cc2c(cc1OC)CCN([C@H]2C)C(=S)Nc1ccc(cc1)F

STK539497
Synonyms: 2-(heptylsulfanyl)-6,6-dimethyl-3-(3-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CC(OC3)(C)C

STK539498
Synonyms: 2,2,3,3,4,4,5,5,5-nonafluoro-N-(3-methylpyridin-2-yl)pentanamide
Smiles: O=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)Nc1ncccc1C

STK539499
Synonyms: N'-[(E)-1H-indol-2-ylmethylidene]furan-2-carbohydrazide
Smiles: O=C(c1ccco1)N/N=C/c1cc2c([nH]1)cccc2

STK539500
Synonyms: 2,2,3,3,4,4,4-heptafluoro-N-[4-(naphthalen-1-yl)-1,3-thiazol-2-yl]butanamide
Smiles: O=C(C(C(C(F)(F)F)(F)F)(F)F)Nc1scc(n1)c1cccc2c1cccc2

STK539501
Synonyms: 4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]phenyl2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanoate
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)C)Oc1ccc(cc1)/C=C/1\C(=O)c2c(C1=O)cccc2

STK539502
Synonyms: 2-({3-[4-(diphenylmethyl)piperazin-1-yl]quinoxalin-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(Nc2nc3ccccc3nc2N2CCN(CC2)C(c2ccccc2)c2ccccc2)sc2c1CCCC2

STK539503
Synonyms: 3-amino-N-(2,4-dichlorophenyl)-6-(3-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1cccc(c1)c1ccc2c(n1)sc(c2N)C(=O)Nc1ccc(cc1Cl)Cl

STK539504
Synonyms: ethyl(2Z)-5-(3-methoxyphenyl)-2-[(1-methyl-1H-indol-3-yl)methylidene]-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(N=c2n(C1c1cccc(c1)OC)c(=O)/c(=C/c1cn(c3c1cccc3)C)/s2)c1ccccc1

STK539505
Synonyms: (6aS,6bR,9aS,10R)-10-[(4-bromophenyl)carbonyl]-3-chloro-8-(naphthalen-1-yl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc3c1cccc3)C=Cc1c2ccc(c1)Cl

STK539507
Synonyms: 9-(3-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-4-methoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: COc1ccc(cc1CN1CCN(CC1)c1ccccc1F)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C

STK539508
Synonyms: 1-(2,6-dimethyl-1H-indol-3-yl)-2-(4-methylpiperidin-1-yl)ethanone
Smiles: CC1CCN(CC1)CC(=O)c1c(C)[nH]c2c1ccc(c2)C

STK539509
Synonyms: (1'R,3R,3'R)-1'-[(4-bromophenyl)carbonyl]-3'-(pyridin-3-ylcarbonyl)-3',3a'-dihydrospiro[indole-3,2'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Smiles: Brc1ccc(cc1)C(=O)[C@@H]1N2c3ccccc3C=CC2[C@@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)c1cccnc1

STK539510
Synonyms: 8-[(2-bromoprop-2-en-1-yl)sulfanyl]-5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: BrC(=C)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK539511
Synonyms: 2-(azepan-1-yl)-N'-[(E)-(4-methoxy-3-nitrophenyl)methylidene]-2-oxoacetohydrazide
Smiles: COc1ccc(cc1[N+](=O)[O-])/C=N/NC(=O)C(=O)N1CCCCCC1

STK539512
Synonyms: 2-[(2,4-dichlorobenzyl)sulfanyl]-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1cc2C(=O)CC(Cc2nc1SCc1ccc(cc1Cl)Cl)(C)C

STK539513
Synonyms: 2-methyl-N'-[(E)-(6-methylpyridin-2-yl)methylidene]quinoline-4-carbohydrazide
Smiles: Cc1cccc(n1)/C=N/NC(=O)c1cc(C)nc2c1cccc2

STK539514
Synonyms: ethyl{[4-benzyl-5-oxo-7-(propan-2-yl)-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)CC(OC3)C(C)C

STK539515
Synonyms: 2-(5-amino-2H-tetrazol-2-yl)-N'-[(E)-1H-indol-3-ylmethylidene]acetohydrazide
Smiles: O=C(Cn1nnc(n1)N)N/N=C/c1c[nH]c2c1cccc2

STK539518
Synonyms: methyl2-({[(4-chlorophenyl)acetyl]carbamothioyl}amino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NC(=O)Cc2ccc(cc2)Cl)sc2c1CCCCCCCCCC2

STK539519
Synonyms: methyl1-(1,3-benzodioxol-5-ylmethyl)-6-oxo-1,6-dihydropyridine-3-carboxylate
Smiles: COC(=O)c1ccc(=O)n(c1)Cc1ccc2c(c1)OCO2

STK539520
Synonyms: 8-[(2-aminoethyl)amino]-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: NCCNc1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C

STK539521
Synonyms: (8S,8aR)-6-amino-8-[2-(trifluoromethyl)phenyl]-8,8a-dihydro-1H-isochromene-5,7,7(3H)-tricarbonitrile
Smiles: N#CC1=C(N)C([C@@H]([C@@H]2C1=CCOC2)c1ccccc1C(F)(F)F)(C#N)C#N

STK539522
Synonyms: 8-[(2E)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-1,3-dimethyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(N/N=C\2/C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)n(c(=O)n2C)C

STK539523
Synonyms: N'-[(1E)-1-(4-bromophenyl)ethylidene]-2-(pyridin-2-ylsulfanyl)acetohydrazide
Smiles: O=C(CSc1ccccn1)N/N=C(/c1ccc(cc1)Br)\C

STK539524
Synonyms: 8-[(4-fluorobenzyl)sulfanyl]-1,3-dimethyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Fc1ccc(cc1)CSc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C

STK539525
Synonyms: 2-{[3-benzyl-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylpropanamide
Smiles: O=C(C(Sc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)C(C)C)C)Nc1ccccc1

STK539527
Synonyms: 8-benzyl-9-(hexylsulfanyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCc1c3cccc1

STK539528
Synonyms: methyl2-({[2-amino-1-(4-fluorobenzyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)NC(=O)c1c(N)n(c2c1nc1ccccc1n2)Cc1ccc(cc1)F

STK539529
Synonyms: N'-[(E)-(4-ethoxy-3-hydroxyphenyl)methylidene]-2-(1H-1,2,4-triazol-1-yl)acetohydrazide
Smiles: CCOc1ccc(cc1O)/C=N/NC(=O)Cn1cncn1

STK539530
Synonyms: (6aS,6bR,9aS,10R)-8-(4-fluorophenyl)-10-[(4-methoxyphenyl)carbonyl]-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Smiles: COc1ccc(cc1)C(=O)[C@@H]1N2[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1)F)C=Cc1c2cccc1

STK539531
Synonyms: 8-(hexylsulfanyl)-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C

STK539532
Synonyms: N-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)glycine
Smiles: Cc1c(C)sc2c1c(NCC(=O)O)ncn2

STK539533
Synonyms: 3-{[(E)-(4-bromophenyl)methylidene]amino}-2-(phenoxymethyl)quinazolin-4(3H)-one
Smiles: Brc1ccc(cc1)/C=N/n1c(COc2ccccc2)nc2c(c1=O)cccc2

STK539534
Synonyms: 3-(4-methoxyphenyl)-2-pentylquinazolin-4(3H)-one
Smiles: CCCCCc1nc2ccccc2c(=O)n1c1ccc(cc1)OC

STK539535
Synonyms: 5-(morpholin-4-yl)-8-(propylsulfanyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1

STK539536
Synonyms: 7-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]heptanamide
Smiles: O=C(NC(C12CC3CC(C2)CC(C1)C3)C)CCCCCCN1C(=O)c2c(C1=O)cccc2

STK539537
Synonyms: (2E)-3-(4-methoxyphenyl)-N-[1-(phenylcarbonyl)-1,2,3,4-tetrahydroquinolin-6-yl]prop-2-enamide
Smiles: COc1ccc(cc1)/C=C/C(=O)Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1

STK539539
Synonyms: ethyl{[11-(2-methylpropyl)-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-3-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)CC(C)C

STK539541
Synonyms: N'-[(E)-(4-chlorophenyl)methylidene]-2-(1H-1,2,4-triazol-1-yl)acetohydrazide
Smiles: O=C(Cn1ncnc1)N/N=C/c1ccc(cc1)Cl

STK539542
Synonyms: 2-(4-methoxyphenyl)-9-nitro-5-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc(cc1)C1=NN2C(C1)c1cc(ccc1OC2c1ccccc1)[N+](=O)[O-]

STK539543
Synonyms: {4-[(4-chlorophenyl)sulfonyl]phenyl}(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)methanone
Smiles: Clc1ccc(cc1)S(=O)(=O)c1ccc(cc1)C(=O)N1CCn2c3C1CCCc3c1c2ccc(c1)C1CCCCC1

STK539544
Synonyms: 7,9-dibromo-5-(4-chlorophenyl)-2-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Smiles: COc1ccc(cc1)C1=NN2C(C1)c1cc(Br)cc(c1OC2c1ccc(cc1)Cl)Br

STK539545
Synonyms: methyl2-({3-[4-(4-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(Nc2nc3ccccc3nc2N2CCN(CC2)c2ccc(cc2)F)sc2c1CCCC2

STK539546
Synonyms: 4-(4-methylphenyl)-1-[(2-phenylethyl)sulfanyl]-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCCc3ccccc3)nnc2n(c1=O)c1ccc(cc1)C)C

STK539548
Synonyms: methyl(1R,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(3,4,5-trimethoxyphenyl)-1,2,3,8a-tetrahydroindolizine-1-carboxylate
Smiles: COC(=O)[C@@]1(C#N)[C@@H]2C=CC(=CN2[C@H]([C@@H]1c1cc(OC)c(c(c1)OC)OC)C(=O)N)C(=O)C

STK539550
Synonyms: 1-(2-hydroxyethyl)-2-imino-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Smiles: OCCn1c(=N)c(C#N)cc2c1nc1ccccn1c2=O

STK539552
Synonyms: 8,8-dimethyl-11-phenyl-7,10-dihydro-8H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(nc2c2ccccc2)sc2c1ncn1c2nnc1