Chemical compounds for High-Throughput screening and
Building Blocks for Combinatorial chemistry

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STK574640
Synonyms: (5E)- 1- benzyl- 5- [(1- benzyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(S)N(C(=O)/C/1=C/c1ccc2c(c1)CCCN2Cc1ccccc1)Cc1ccccc1

STK574641
Synonyms: (2S)- N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 3- methyl- 2- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: CC([C@H](n1cnc2c(c1=O)cccc2)C(=O)Nc1ccc2c(c1)OCCO2)C

STK574644
Synonyms: 4- chloro- N- [(3Z)- 1- ethyl- 7- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]benzenesulfonamide
Smiles: CCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)Cl)/c2c1nc1cc(C)ccc1c2

STK574645
Synonyms: 4- methyl- 3- (4- methylbenzyl)pyrimido[1,2- a]benzimidazol- 2- ol
Smiles: Cc1ccc(cc1)Cc1c(O)nc2n(c1C)c1ccccc1n2

STK574646
Synonyms: methylN- {[(3R,5S)- 3,5- dimethylpiperidin- 1- yl]carbonyl}- L- leucinate
Smiles: COC(=O)[C@@H](NC(=O)N1C[C@H](C)C[C@@H](C1)C)CC(C)C

STK574648
Synonyms: ethyl(2E)- 2- ({(2E)- 3- [4- (hexyloxy)- 3- methoxyphenyl]prop- 2- enoyl}imino)- 4- methyl- 2,3- dihydro- 1,3- thiazole- 5- carboxylate
Smiles: CCCCCCOc1ccc(cc1OC)/C=C/C(=O)/N=c/1\[nH]c(c(s1)C(=O)OCC)C

STK574649
Synonyms: 1'- (3- methoxypropyl)- 6a,7,8,9,10,11- hexahydro- 2'H,5H- spiro[azepino[1,2- a]quinoline- 6,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: COCCCN1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CCCCC1

STK574650
Synonyms: 3- (2- methoxybenzyl)- 5- (propan- 2- yl)- 3H- pyrrolo[2',3':4,5]pyrimido[1,6- a]benzimidazol- 1- yl2- methylpropanoate
Smiles: COc1ccccc1Cn1cc(c2c1nc(C(C)C)n1c2nc2c1cccc2)OC(=O)C(C)C

STK574651
Synonyms: 2- {[4- (furan- 2- ylmethyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nnc(n1Cc1ccco1)COc1ccccc1

STK574652
Synonyms: (4E)- 1- (3- chlorophenyl)- 5- (4- ethoxyphenyl)- 4- [hydroxy(phenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1cccc(c1)Cl

STK574653
Synonyms: 4,5- dimethoxy- N- [(2E)- 6- methoxy- 1,3- benzothiazol- 2(3H)- ylidene]- 2- nitrobenzamide
Smiles: COc1ccc2c(c1)s/c(=N/C(=O)c1cc(OC)c(cc1[N+](=O)[O-])OC)/[nH]2

STK574654
Synonyms: (2E,5Z)- 2- [(4- hydroxyphenyl)imino]- 5- [(1- methyl- 1H- pyrrol- 2- yl)methylidene]- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: Oc1ccc(cc1)/N=C\1/S/C(=C\c2cccn2C)/C(=N1)O

STK574655
Synonyms: methylN- [(2- fluorophenyl)carbamoyl]- D- leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1F)CC(C)C

STK574656
Synonyms: (2Z)- 2- (2,3- dimethoxybenzylidene)- 6- [2- oxo- 2- (pyrrolidin- 1- yl)ethoxy]- 1- benzofuran- 3(2H)- one
Smiles: COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N1CCCC1

STK574657
Synonyms: 2- (1,3- benzothiazol- 2- yl)- 1- (3- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: [O-][N+](=O)c1cccc(c1)C1N(c2nc3c(s2)cccc3)C(=O)c2c1c(=O)c1c(o2)cccc1

STK574658
Synonyms: 2- ({5- [(4- methylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- methylphenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C)nnc1COc1ccc(cc1)C

STK574659
Synonyms: (5Z)- 3- [2- (3,4- dimethoxyphenyl)ethyl]- 5- {[(4- fluorophenyl)amino]methylidene}- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cc(CCN2C(=O)N=C(/C(=C/Nc3ccc(cc3)F)/C2=O)O)ccc1OC

STK574660
Synonyms: {4- [(3aR,4R,4aR,7aS,8R,8aR)- 6- benzyl- 5,7- dioxo- 4,4a,5,6,7,7a,8,8a- octahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindol- 3- yl]phenoxy}acetonitrile
Smiles: N#CCOc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)Cc1ccccc1

STK574661
Synonyms: 2- methyl- 6,9- diphenyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Cc1nn2c(n1)N=C1C(=C(O)CC(C1)c1ccccc1)C2c1ccccc1

STK574662
Synonyms: N- [4- (benzyloxy)phenyl]- 2- {[5- (4- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl

STK574663
Synonyms: (6E)- 4- (1- benzofuran- 2- yl)- 6- [(2,4- dichlorophenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: Clc1ccc(c(c1)Cl)/N=c/1\[nH]c(N)nc(n1)c1cc2c(o1)cccc2

STK574664
Synonyms: 4- [8,9- di(furan- 2- yl)furo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]- N,N- dimethylaniline
Smiles: CN(c1ccc(cc1)c1nn2c(n1)c1c(nc2)oc(c1c1ccco1)c1ccco1)C

STK574665
Synonyms: 2- hydroxy- 7- methoxy- 3- ({(E)- [4- (pentyloxy)phenyl]methylidene}amino)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCCCCOc1ccc(cc1)/C=N/n1c(O)nc2c(c1=O)[nH]c1c2ccc(c1)OC

STK574668
Synonyms: (3S)- N- {2- [(2- methoxy- 5- methylphenyl)amino]- 2- oxoethyl}- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: COc1ccc(cc1NC(=O)CNC(=O)[C@H]1NCc2c(C1)cccc2)C

STK574669
Synonyms: 8- [(2- nitrophenyl)sulfonyl]- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: [O-][N+](=O)c1ccccc1S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK574670
Synonyms: (3E)- 3- [(6- chloro- 4- oxo- 4H- chromen- 3- yl)methylidene]- 4- imino- 3,4- dihydro- 2H- pyrimido[2,1- b][1,3]benzothiazol- 2- one
Smiles: Clc1ccc2c(c1)c(=O)c(co2)/C=C\1/C(=O)N=c2n(C1=N)c1ccccc1s2

STK574672
Synonyms: 2- {[3- cyano- 5- hydroxy- 4- (4- methoxyphenyl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (2- ethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2CC)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)OC

STK574674
Synonyms: 5- (3,4- dichlorophenyl)- N'- [(1E,2E)- 3- (2- methoxyphenyl)prop- 2- en- 1- ylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: COc1ccccc1/C=C/C=N/NC(=O)c1n[nH]c(c1)c1ccc(c(c1)Cl)Cl

STK574675
Synonyms: N'- [(E)- (2,5- dimethoxyphenyl)methylidene]- 5,6- dimethoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1ccc(c(c1)/C=N/NC(=O)c1cc2c([nH]1)cc(c(c2)OC)OC)OC

STK574678
Synonyms: 5- benzyl- 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (3- ethoxy- 4- hydroxyphenyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: CCOc1cc(ccc1O)C1N(Cc2ccccc2)C(=O)c2c1c([nH]n2)c1cc(Cl)c(cc1O)C

STK574680
Synonyms: 8- fluoro- 5- methyl- 3- (tetrahydrofuran- 2- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Fc1ccc2c(c1)c1ncn(c(=O)c1n2C)CC1CCCO1

STK574681
Synonyms: 4- {[(E)- (3,4- dichlorophenyl)methylidene]amino}- 5- (3- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)Cl)Cl

STK574682
Synonyms: 5- (methylamino)- 1,3,4- thiadiazole- 2(3H)- thione
Smiles: CNc1n[nH]c(=S)s1

STK574683
Synonyms: 2- [(4,6- dimethylquinazolin- 2- yl)amino]- 6- methyl- 5- (3- methylbutyl)pyrimidin- 4- ol
Smiles: CC(CCc1c(C)nc(nc1O)Nc1nc(C)c2c(n1)ccc(c2)C)C

STK574684
Synonyms: 2- [2- (furan- 2- yl)- 8,9- diphenyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl]ethanol
Smiles: OCCn1c(c2ccccc2)c(c2c1ncn1c2nc(n1)c1ccco1)c1ccccc1

STK574685
Synonyms: 6- (2- hydroxyphenyl)- 9- (4- methylphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Cc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1O

STK574686
Synonyms: (5,6- dimethoxy- 1H- indol- 2- yl)[4- (3- methoxyphenyl)piperazin- 1- yl]methanone
Smiles: COc1cccc(c1)N1CCN(CC1)C(=O)c1cc2c([nH]1)cc(c(c2)OC)OC

STK574687
Synonyms: 2- (ethylsulfanyl)- 6,6- dimethyl- 9- (2,4,5- trimethoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nc2n(n1)C(C1=C(O)CC(CC1=N2)(C)C)c1cc(OC)c(cc1OC)OC

STK574688
Synonyms: {4- [4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]piperazin- 1- yl}(phenyl)methanone
Smiles: CC(Cc1nc2sc3c(c2c2c1CCC2)ncnc3N1CCN(CC1)C(=O)c1ccccc1)C

STK574690
Synonyms: (1R,2S)- 2- [(2- cyanoethyl)(methyl)carbamoyl]cyclohexanecarboxylicacid
Smiles: N#CCCN(C(=O)[C@H]1CCCC[C@H]1C(=O)O)C

STK574691
Synonyms: N- {[6- chloro- 8- (trifluoromethyl)[1,2,4]triazolo[4,3- a]pyridin- 3- yl]methyl}pyridine- 3- carboxamide
Smiles: Clc1cc(c2n(c1)c(CNC(=O)c1cccnc1)nn2)C(F)(F)F

STK574693
Synonyms: 7- methyl- 3- (pyridin- 3- ylmethyl)- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cc1ccc2c(c1)[nH]c1c2ncn(c1=O)Cc1cccnc1

STK574694
Synonyms: 1,3- dimethyl- 8- [(2- methylpiperidin- 1- yl)methyl]- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCCCN1Cc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C

STK574696
Synonyms: 1- (4- chlorophenyl)- 7- fluoro- 2- (6- methylpyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Clc1ccc(cc1)C1N(c2cccc(n2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK574697
Synonyms: (3R,3'S,5'S)- N- (2,5- dimethoxyphenyl)- 5- methyl- 5'- (2- methylpropyl)- 2- oxo- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1)CC(C)C)OC

STK574699
Synonyms: 6- [(4- ethylpiperazin- 1- ium- 1- yl)methyl]- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])ccc2c1oc(=O)c1c2CCC1

STK574700
Synonyms: [4- (4- methylphenyl)- 2- (pyridin- 3- yl)- 1,3- thiazol- 5- yl]aceticacid
Smiles: OC(=O)Cc1sc(nc1c1ccc(cc1)C)c1cccnc1

STK574701
Synonyms: 4,7- dimethyl- 6- [(4- methylpiperidinium- 1- yl)methyl]- 2- oxo- 2H- chromen- 5- olate
Smiles: CC1CC[NH+](CC1)Cc1c(C)cc2c(c1[O-])c(C)cc(=O)o2

STK574702
Synonyms: N- (5- chloro- 2- methylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK574703
Synonyms: 2- [(E)- {(2E)- [4- (3- nitrophenyl)- 1,3- thiazol- 2(3H)- ylidene]hydrazinylidene}methyl]pyridine
Smiles: [O-][N+](=O)c1cccc(c1)c1cs/c(=N/N=C/c2ccccn2)/[nH]1

STK574704
Synonyms: N- (3- methoxypropyl)- 5,10- dimethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: COCCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)CC2

STK574707
Synonyms: 6- (4- methoxyphenyl)- 2- [(4,6,7- trimethylquinazolin- 2- yl)amino]pyrimidin- 4- ol
Smiles: COc1ccc(cc1)c1nc(nc(c1)O)Nc1nc(C)c2c(n1)cc(c(c2)C)C

STK574708
Synonyms: 2- {4- [7- (2,4- dichlorobenzyl)- 6- hydroxy- 3- methyl- 2- oxo- 3,7- dihydro- 2H- purin- 8- yl]piperazin- 1- yl}acetamide
Smiles: NC(=O)CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1Cl)Cl)c(O)nc(=O)n2C

STK574712
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- cyclohexylacetamide
Smiles: O=C(NC1CCCCC1)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK574713
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1Cc1cccs1

STK574714
Synonyms: 2- (6- chloro- 1,3- benzothiazol- 2- yl)- 1- (3- ethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1cccc(c1)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK574716
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)C)nnc1COc1ccccc1

STK574717
Synonyms: N- [4- (dimethylamino)phenyl]- 2- ({4- (4- methoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1COc1ccc(cc1)C

STK574718
Synonyms: 5- (3- methylphenyl)- 4- {[(E)- (3- phenoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)Oc1ccccc1

STK574720
Synonyms: N- (2,3- dimethylphenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)C)nnc1COc1ccc(cc1)C

STK574721
Synonyms: 1- hydroxy- 5- methyl- 9- oxo- 9H- xanthen- 3- ylN- [(benzyloxy)carbonyl]norleucinate
Smiles: CCCCC(C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)NC(=O)OCc1ccccc1

STK574722
Synonyms: 7- bromo- 1- (3- chlorophenyl)- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Clc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Br

STK574723
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: COc1ccc(c(c1)OC)NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK574724
Synonyms: 5,9- dimethyl- 2- (pyridin- 3- yl)- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)c1cccnc1

STK574726
Synonyms: (1Z)- 4,4,6,8- tetramethyl- 1- (4- oxo- 2- sulfanyl- 1,3- thiazol- 5(4H)- ylidene)- 5,6- dihydro- 4H- pyrrolo[3,2,1- ij]quinolin- 2(1H)- one
Smiles: Cc1cc2C(C)CC(N3c2c(c1)/C(=C\1/SC(=NC1=O)S)/C3=O)(C)C

STK574727
Synonyms: 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1

STK574729
Synonyms: 4- (butylsulfanyl)- 7,7- dimethyl- 2- (3- methylphenyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: CCCCSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C

STK574731
Synonyms: 2,2- dimethyl- 8- (piperazin- 1- yl)- 5- propyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3N1CCNCC1

STK574736
Synonyms: 2- {(2E)- [(2- methyl- 1H- indol- 3- yl)methylidene]hydrazinylidene}- 2,3- dihydro- 1H- benzimidazole
Smiles: Cc1[nH]c2c(c1/C=N/N=c/1\[nH]c3c([nH]1)cccc3)cccc2

STK574740
Synonyms: 2- chloro- N'- {(1E)- 1- [1- (4- chlorophenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}benzohydrazide
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C(\NNC(=O)c2ccccc2Cl)/C)/C1=O)O

STK574742
Synonyms: 4- {[(1E,2Z)- 2- chloro- 3- phenylprop- 2- en- 1- ylidene]amino}- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/C(=C/c1ccccc1)/Cl

STK574743
Synonyms: N- [(3- hydroxyquinoxalin- 1(2H)- yl)carbonyl]- beta- alanine
Smiles: OC(=O)CCNC(=O)N1CC(=Nc2c1cccc2)O

STK574745
Synonyms: (5Z)- 3- (2- bromophenyl)- 5- (4- fluorobenzylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Fc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)c1ccccc1Br

STK574747
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK574748
Synonyms: 2- {[7,7- dimethyl- 2- (3- methylphenyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- N- methyl- N- phenylacetamide
Smiles: Cc1cccc(c1)c1nc(SCC(=O)N(c2ccccc2)C)c2c(n1)CC(OC2)(C)C

STK574749
Synonyms: 2- chloro- N'- [(E)- (4,6- dioxo- 1- phenyl- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene)methyl]benzohydrazide
Smiles: SC1=NC(=O)/C(=C\NNC(=O)c2ccccc2Cl)/C(=O)N1c1ccccc1

STK574750
Synonyms: 2- ({2,2- dicyano- 1- [(4- fluorophenyl)amino]ethenyl}sulfanyl)- N,N- diethylacetamide
Smiles: CCN(C(=O)CSC(=C(C#N)C#N)Nc1ccc(cc1)F)CC

STK574752
Synonyms: N- [(2Z)- 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]butanamide
Smiles: CCCC(=O)/N=C/1\SC2C(N1c1ccc3c(c1)OCCO3)CS(=O)(=O)C2

STK574753
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- {[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK574754
Synonyms: N- (2,4- difluorophenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK574755
Synonyms: 8- [4- (2- chlorobenzyl)piperazin- 1- yl]- 6- hydroxy- 3- methyl- 7- (2- methylpropyl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(Cn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccccc1Cl)C

STK574756
Synonyms: 8- {(2E)- 2- [4- (benzyloxy)benzylidene]hydrazinyl}- 6- hydroxy- 3,7- dimethyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1n(C)c(n2)N/N=C/c1ccc(cc1)OCc1ccccc1)C

STK574757
Synonyms: 2- ethyl- 10- methyl- 3- (4- methylphenyl)pyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCc1nc2c(c(=O)n1c1ccc(cc1)C)c(=O)c1c(n2C)cccc1

STK574759
Synonyms: 2- amino- 1- (3,4- dimethoxyphenyl)- N- (2- methoxyethyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: COCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)OC)OC

STK574761
Synonyms: 7- (furan- 2- yl)- 5- hydroxy- 2- methyl- N- (6- methylpyridin- 2- yl)- 4- phenyl- 4,6,7,8- tetrahydroquinoline- 3- carboxamide
Smiles: Cc1cccc(n1)NC(=O)C1=C(C)N=C2C(=C(O)CC(C2)c2ccco2)C1c1ccccc1

STK574762
Synonyms: 4- {[(E)- (2,3- dichlorophenyl)methylidene]amino}- 5- [3- (propan- 2- yloxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1Cl)Cl)C

STK574763
Synonyms: 2- chloro- N- {1- methyl- 4- oxo- 3- [3- (trifluoromethyl)phenyl]- 1,4- dihydroquinolin- 2- yl}benzamide
Smiles: O=C(c1ccccc1Cl)Nc1n(C)c2ccccc2c(=O)c1c1cccc(c1)C(F)(F)F

STK574765
Synonyms: N- (4- fluorophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)F)nnc1Cc1cccs1

STK574766
Synonyms: {4- [3- (4- chlorophenyl)- 2- methyl- 5- phenylpyrazolo[1,5- a]pyrimidin- 7- yl]piperazin- 1- yl}acetonitrile
Smiles: N#CCN1CCN(CC1)c1cc(nc2n1nc(c2c1ccc(cc1)Cl)C)c1ccccc1

STK574767
Synonyms: 3- {(2S)- 1- [4- (4- fluorophenyl)piperazin- 1- yl]- 3- methyl- 1- oxobutan- 2- yl}quinazolin- 4(3H)- one
Smiles: CC([C@H](n1cnc2c(c1=O)cccc2)C(=O)N1CCN(CC1)c1ccc(cc1)F)C

STK574769
Synonyms: 2- methoxyethyl2- amino- 4- (3,4- dichlorophenyl)- 6- (hydroxymethyl)- 8- oxo- 4,8- dihydropyrano[3,2- b]pyran- 3- carboxylate
Smiles: COCCOC(=O)C1=C(N)Oc2c(C1c1ccc(c(c1)Cl)Cl)oc(cc2=O)CO

STK574770
Synonyms: 1- (4- chlorophenyl)- N- (3- methoxyphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)Cl)CCCC3)c1ccc(cc1)C

STK574772
Synonyms: 8- [4- (2,6- dichlorobenzyl)piperazin- 1- yl]- 7- ethyl- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1c(Cl)cccc1Cl

STK574773
Synonyms: 3- amino- N- [2- (1H- indol- 3- yl)ethyl]- 6- methyl- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridine- 2- carboxamide
Smiles: CN1CCc2c(C1)cc1c(n2)sc(c1N)C(=O)NCCc1c[nH]c2c1cccc2

STK574774
Synonyms: 2- (4- fluorophenyl)- N- [(2E)- 3- (3- methoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: COc1cccc(c1)N1/C(=N\C(=O)Cc2ccc(cc2)F)/SC2C1CS(=O)(=O)C2

STK574776
Synonyms: 7- (2- fluorobenzyl)- 1,3- dimethyl- 8- [(4- phenylpiperazin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccccc1Cn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C

STK574777
Synonyms: 4- (4- ethylpiperazin- 1- yl)- 8,10- dimethyl- 2- propylpyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: CCCc1cc(N2CCN(CC2)CC)n2c(n1)c1c(C)cc(nc1n2)C

STK574778
Synonyms: N- cyclohexyl- 2- {[4- (4- methylphenyl)- 5- oxo- 4,5,7,8- tetrahydro- 6H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[4,3- a]pyrimidin- 1- yl]sulfanyl}acetamide
Smiles: O=C(NC1CCCCC1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCC3

STK574779
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- methylphenyl)carbonyl]- 2'- [(3- nitrophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Cc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccc(c1)[N+](=O)[O-])C(=O)Nc1c2cccc1)cccc3

STK574780
Synonyms: N- [(2Z)- 3- (2- methoxy- 5- methylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: COc1ccc(cc1N1/C(=N/C(=O)C)/SC2C1CS(=O)(=O)C2)C

STK574781
Synonyms: 7'- {(E)- [2- hydroxy- 1- (3- methoxyphenyl)- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trio
Smiles: COc1cccc(c1)N1C(=NC(=O)/C(=C\c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK574782
Synonyms: methylN- [(4- butylphenyl)carbamoyl]- D- alaninate
Smiles: CCCCc1ccc(cc1)NC(=O)N[C@@H](C(=O)OC)C

STK574783
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 5- hydroxy- 7,7- dimethyl- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (2- methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)Cl

STK574784
Synonyms: N- (3,5- dimethylphenyl)- 2- ({4- (4- methoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)cc(c2)C)nnc1COc1ccc(cc1)C

STK574785
Synonyms: (4E)- 4- [hydroxy(thiophen- 2- yl)methylidene]- 5- (3- methoxyphenyl)- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: COc1cccc(c1)C1/C(=C(/c2cccs2)\O)/C(=O)C(=O)N1c1nnc(s1)SC

STK574787
Synonyms: (1'R,2'R)- 7'- chloro- 1'- [(3- methoxyphenyl)carbonyl]- 2'- phenyl- 1',2'- dihydro- 3a'H- spiro[indene- 2,3'- pyrrolo[1,2- a]quinoline]- 1,3- dione
Smiles: COc1cccc(c1)C(=O)[C@@H]1N2c3ccc(cc3C=CC2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1)Cl

STK574788
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- (2- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK574789
Synonyms: 4- ({(E)- [4- (benzyloxy)- 3- methoxyphenyl]methylidene}amino)- 5- [4- (dimethylamino)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(ccc1OCc1ccccc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)N(C)C

STK574790
Synonyms: 6- amino- 4- (3,4- dihydroxyphenyl)- 3- methyl- 1- phenyl- 1H- pyrazolo[3,4- b]pyridine- 5- carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(c(c1)O)O)c(C)nn2c1ccccc1

STK574792
Synonyms: (4- methylphenyl)(3,5,6,7- tetrahydro- 1'H- spiro[imidazo[4,5- c]pyridine- 4,4'- piperidin]- 1'- yl)methanone
Smiles: Cc1ccc(cc1)C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1

STK574793
Synonyms: 4- [(E)- [2- (3,4- dimethoxyphenyl)- 1- (3- methoxypropyl)- 4,5- dioxopyrrolidin- 3- ylidene](hydroxy)methyl]- N,N- dimethylbenzenesulfonamide
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)S(=O)(=O)N(C)C)/O)/C1c1ccc(c(c1)OC)OC

STK574795
Synonyms: 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 8- [(3- methoxypropyl)amino]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COCCCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C

STK574796
Synonyms: N- [2- hydroxy- 1- (4- methoxybenzyl)- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]benzamide
Smiles: COc1ccc(cc1)CN1C(=NC(C1=O)(NC(=O)c1ccccc1)C(F)(F)F)O

STK574797
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- phenylmethylidene]- 5- (4- propoxyphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1

STK574798
Synonyms: 5- (2- chlorophenyl)- 4- {[(E)- (2- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK574799
Synonyms: 5- {[(2Z)- 3- (4- methoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]amino}- 5- oxopentanoicacid
Smiles: COc1ccc(cc1)CN1/C(=N/C(=O)CCCC(=O)O)/SC2C1CS(=O)(=O)C2

STK574802
Synonyms: N- [7- (2- chlorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]methanesulfonamide
Smiles: Clc1ccccc1C1C=C(N=c2n1nc([nH]2)NS(=O)(=O)C)c1ccccc1

STK574803
Synonyms: 1- (2,5- dimethoxyphenyl)- 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(c(c1)C1N(c2nc3c(s2)cc(cc3)F)C(=O)c2c1c(=O)c1c(o2)cccc1)OC

STK574804
Synonyms: (E)- N- {[10- methyl- 11- (4- methylphenyl)- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- phenylmethanimine
Smiles: Cc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C/c1ccccc1)c1ccccc1

STK574806
Synonyms: [1- amino- 8,8- dimethyl- 5- (pyrrolidin- 1- yl)- 8,9- dihydro- 6H- pyrano[4,3- d]thieno[2,3- b]pyridin- 2- yl](pyrrolidin- 1- yl)methanone
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCCC1)N1CCCC1

STK574807
Synonyms: 2- methyl- 3- phenyl- 9- (pyridin- 3- yl)- 5,6,7,9- tetrahydropyrazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2cccnc2)nc(c3c2ccccc2)C)CCC1

STK574808
Synonyms: (4E)- 4- [hydroxy(4- methylphenyl)methylidene]- 1- (4- iodophenyl)- 5- phenylpyrrolidine- 2,3- dione
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1ccc(cc1)I)/O

STK574809
Synonyms: 7- methyl- N- [(2Z)- 5- (methylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: CSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(cc3)C)/s1

STK574811
Synonyms: 8- (cyclohexylamino)- 6- hydroxy- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OC(Cn1c(NC2CCCCC2)nc2c1c(O)nc(=O)n2C)COc1ccc(cc1)C

STK574812
Synonyms: 4- (4- chlorophenyl)- 3- (4- methylphenyl)- 5- phenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: Cc1ccc(cc1)c1[nH]nc2c1C(c1ccc(cc1)Cl)N(C2=O)c1ccccc1

STK574814
Synonyms: methylN- [(4- ethoxyphenyl)carbamoyl]- L- alaninate
Smiles: CCOc1ccc(cc1)NC(=O)N[C@H](C(=O)OC)C

STK574816
Synonyms: (5Z)- 5- ({[2- (diethylamino)ethyl]amino}methylidene)- 6- hydroxy- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: CCN(CCN/C=C\1/C(=NC(=NC1=O)S)O)CC

STK574817
Synonyms: 6- chloro- 1- hydroxy- 9- oxo- 9H- xanthen- 3- yl(2S)- [(tert- butoxycarbonyl)amino](phenyl)ethanoate
Smiles: O=C(OC(C)(C)C)N[C@@H](c1ccccc1)C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)ccc(c1)Cl

STK574819
Synonyms: 9a- [(E)- 2- {4- [(4- chlorobenzyl)oxy]- 3- methoxyphenyl}ethenyl]- 7,9,9- trimethyl- 9,9a- dihydro- 1H- imidazo[1,2- a]indol- 2(3H)- one
Smiles: COc1cc(/C=C/C23NC(=O)CN2c2c(C3(C)C)cc(cc2)C)ccc1OCc1ccc(cc1)Cl

STK574820
Synonyms: N- {(2S)- 3- methyl- 1- [(2- methylpropyl)amino]- 1- oxobutan- 2- yl}- 1- [(4- methylphenyl)sulfonyl]piperidine- 4- carboxamide
Smiles: CC(CNC(=O)[C@H](C(C)C)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)C

STK574821
Synonyms: 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- ylN- [(4- methylphenyl)sulfonyl]norleucinate
Smiles: CCCCC(C(=O)Oc1ccc2c(c1)oc(=O)c1c2CCCC1)NS(=O)(=O)c1ccc(cc1)C

STK574822
Synonyms: 2- {[4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- yl]amino}butan- 1- ol
Smiles: CCC(Nc1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C)CO

STK574823
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK574824
Synonyms: 2- (6- chloro- 1,3- benzothiazol- 2- yl)- 1- (4- methylphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK574825
Synonyms: 4- {[(E)- (5- bromo- 2- fluorophenyl)methylidene]amino}- 5- (3- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cc(Br)ccc1F

STK574826
Synonyms: 5- {3- [(2- chlorobenzyl)oxy]phenyl}- N'- [(E)- furan- 2- ylmethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1Cl)N/N=C/c1ccco1

STK574827
Synonyms: N- (3- chloro- 4- methoxyphenyl)- 2- {[5- (4- fluorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)OC)nnc1c1ccc(cc1)F

STK574828
Synonyms: 2- [2- (furan- 2- yl)- 5- hydroxy[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: Oc1nc2nc(nn2c(c1)N1C(=O)c2c(C1=O)cccc2)c1ccco1

STK574829
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- {[methyl(phenyl)amino]methyl}- N'- [(E)- (3- methylthiophen- 2- yl)methylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: O=C(c1nnn(c1CN(c1ccccc1)C)c1nonc1N)N/N=C/c1sccc1C

STK574831
Synonyms: 4- methoxy- N- (7- methyl- 2,3- dihydro- 1H- pyrrolo[2,3- b]quinolin- 1- yl)benzamide
Smiles: COc1ccc(cc1)C(=O)NN1CCc2c1nc1cc(C)ccc1c2

STK574832
Synonyms: 2- [5- hydroxy- 2- (4- methoxyphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]hexahydro- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1ccc(cc1)c1nn2c(n1)nc(cc2N1C(=O)C2C(C1=O)CCCC2)O

STK574833
Synonyms: 7- (2- chlorobenzyl)- 6- hydroxy- 3- methyl- 8- [(3- oxobutan- 2- yl)sulfanyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(=O)C(Sc1nc2c(n1Cc1ccccc1Cl)c(O)nc(=O)n2C)C

STK574835
Synonyms: 4,6- dimethoxy- N'- [(E)- (4- methoxyphenyl)methylidene]- 1H- indole- 2- carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1cc2c([nH]1)cc(cc2OC)OC

STK574836
Synonyms: N- [N- (2,5- dimethoxyphenyl)- N'- (4,6- dimethylpyrimidin- 2- yl)carbamimidoyl]- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)N/C(=N/c1nc(C)cc(n1)C)/Nc1cc(OC)ccc1OC

STK574838
Synonyms: 2- [(9- tert- butyl- 1,5- dicyano- 4- hydroxy- 3- azaspiro[5.5]undeca- 1,3- dien- 2- yl)sulfanyl]- N- (4- fluorophenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)F)N=C(C(C21CCC(CC2)C(C)(C)C)C#N)O

STK574839
Synonyms: 8- (4- ethoxyphenyl)- 1- methyl- 3- (3- methylbenzyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1cccc(c1)C

STK574842
Synonyms: 8- methoxy- 5- methyl- 3- [2- (piperazin- 1- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1n2C)CCN1CCNCC1

STK574843
Synonyms: 7- chloro- 1- (2,5- dimethoxyphenyl)- 6- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(c(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C)OC

STK574844
Synonyms: 1- hydroxy- 5- methyl- 9- oxo- 9H- xanthen- 3- ylN- [(benzyloxy)carbonyl]- D- alaninate
Smiles: O=C(N[C@@H](C(=O)Oc1cc(O)c2c(c1)oc1c(c2=O)cccc1C)C)OCc1ccccc1

STK574846
Synonyms: 2- {[5- (2- chlorophenyl)- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (dimethylamino)phenyl]acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)N(C)C)nnc1c1ccccc1Cl

STK574847
Synonyms: (5E)- 1- (2,4- dimethylphenyl)- 5- {[(2- phenylethyl)amino]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: Cc1ccc(c(c1)C)N1C(=NC(=O)/C(=C\NCCc2ccccc2)/C1=O)S

STK574848
Synonyms: 4- (3,4- dichlorophenyl)- 1- (4- fluorophenyl)- N- (3- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)F)CCCC3)c1ccc(c(c1)Cl)Cl

STK574849
Synonyms: N- (3- methoxybenzyl)- 2- (5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)acetamide
Smiles: COc1cccc(c1)CNC(=O)Cn1c2ccccc2c2c1c(=O)n1c(n2)SCC1

STK574850
Synonyms: 6- methoxy- N- (1- phenylethyl)- 1H- indole- 2- carboxamide
Smiles: COc1ccc2c(c1)[nH]c(c2)C(=O)NC(c1ccccc1)C

STK574853
Synonyms: 6- chloro- 3- [4- (4- methoxyphenyl)piperazin- 1- yl]- 4- phenylquinolin- 2- ol
Smiles: COc1ccc(cc1)N1CCN(CC1)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK574855
Synonyms: 4- {[(E)- (5- bromothiophen- 2- yl)methylidene]amino}- 5- phenyl- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1ccc(s1)/C=N/n1c(=S)[nH]nc1c1ccccc1

STK574856
Synonyms: N- (4- bromophenyl)- 2- ({5- [(4- methylphenoxy)methyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)Br)nnc1COc1ccc(cc1)C

STK574857
Synonyms: (4E)- 2- (2- chloro- 4- fluorophenyl)- 4- (ethoxymethylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: CCO/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1Cl)F

STK574858
Synonyms: 5- (2- chlorophenyl)- 4- {[(E)- (3- phenoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccc(c1)Oc1ccccc1

STK574860
Synonyms: 5,10- dimethyl- 2- (pyridin- 4- yl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CC1CCc2c(C1)c1c(s2)nc(n2c1nc(n2)c1ccncc1)C

STK574861
Synonyms: (3S,3a'R,8a'S,8b'S)- 5- chloro- 2'- (4- methoxyphenyl)- 7- methyl- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: COc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C

STK574862
Synonyms: (4E)- 5- (3,4- dimethoxyphenyl)- 4- [hydroxy(phenyl)methylidene]- 1- (3- hydroxypropyl)pyrrolidine- 2,3- dione
Smiles: OCCCN1C(=O)C(=O)/C(=C(\c2ccccc2)/O)/C1c1ccc(c(c1)OC)OC

STK574863
Synonyms: 4- [(2E)- 2- {[5- (4- bromophenyl)furan- 2- yl]methylidene}hydrazinyl]- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidine
Smiles: Brc1ccc(cc1)c1ccc(o1)/C=N/Nc1ncnc2c1c1CCCCc1s2

STK574865
Synonyms: 10,10- dimethyl- 2- (pyrrolidin- 1- ylmethyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(s2)ncn2c1nc(n2)CN1CCCC1

STK574866
Synonyms: 4- (3,4- dichlorophenyl)- N- (3- methylphenyl)- 1- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccccc1)CCCC3)c1ccc(c(c1)Cl)Cl

STK574868
Synonyms: 1- (3,4- dimethoxyphenyl)- 2- (2- phenylethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1OC)C1N(CCc2ccccc2)C(=O)c2c1c(=O)c1c(o2)cccc1

STK574870
Synonyms: (4Z)- 4- [(2- fluorophenyl)imino]- 6- (3- methyl- 1- benzofuran- 2- yl)- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1n/c(=N\c2ccccc2F)/[nH]c(n1)c1oc2c(c1C)cccc2

STK574872
Synonyms: (5Z)- 6- hydroxy- 5- {[1- (3- hydroxyphenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 3- (4- methoxyphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1ccc(cc1)N1C(=O)N=C(/C(=C/c2cc(n(c2C)c2cccc(c2)O)C)/C1=O)O

STK574873
Synonyms: 6- cyclopentyl- 2- sulfanyl- 1- [3- (trifluoromethyl)phenyl]- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(S)n(c2c1CN(CN2)C1CCCC1)c1cccc(c1)C(F)(F)F

STK574875
Synonyms: ethyl4- {[(2Z)- 2- (4- hydroxy- 2- oxo- 1,3- thiazol- 5(2H)- ylidene)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)/C=C/1\SC(=O)N=C1O

STK574876
Synonyms: (4E)- 2- (2,4- dimethoxyphenyl)- 4- {[(pyridin- 2- ylmethyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(c(c1)OC)N1C(=O)/C(=C/NCc2ccccn2)/c2c(C1=O)cccc2

STK574877
Synonyms: (4E)- 1- {5- [(2- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 5- (2- fluorophenyl)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]pyrrolidine- 2,3- dione
Smiles: CC1Oc2c(C1)cc(cc2)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)c1nnc(s1)SCc1ccccc1Cl)/O

STK574878
Synonyms: (5E)- 5- [4- (benzyloxy)- 3- methoxybenzylidene]- 2- hydroxy- 1- (2,4,6- trimethylphenyl)pyrimidine- 4,6(1H,5H)- dione
Smiles: COc1cc(ccc1OCc1ccccc1)/C=C/1\C(=O)N=C(N(C1=O)c1c(C)cc(cc1C)C)O

STK574879
Synonyms: ([(2,6- dichlorobenzyl)sulfanyl]{[3- (trifluoromethyl)phenyl]amino}methylidene)propanedinitrile
Smiles: N#CC(=C(Nc1cccc(c1)C(F)(F)F)SCc1c(Cl)cccc1Cl)C#N

STK574880
Synonyms: 4- (2- fluorophenyl)- 2- (4- fluorophenyl)- 1,2,3,4- tetrahydropyrimido[1,2- a]benzimidazole
Smiles: Fc1ccc(cc1)C1Nc2nc3c(n2C(C1)c1ccccc1F)cccc3

STK574882
Synonyms: N- (5- chloro- 2- methylphenyl)- 2- ({5- [(4- chlorophenoxy)methyl]- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK574883
Synonyms: 3- chloro- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- methylbenzamide
Smiles: COc1ccc2c(c1)cc(c(=O)[nH]2)CN(C(=O)c1cccc(c1)Cl)C

STK574885
Synonyms: 8- (3,4- dimethylphenyl)- 1,7- dimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Cc1ccc(cc1C)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK574886
Synonyms: (1'S,3R,3'S,7a'S)- 7''- chloro- 5''- methyl- 1'- {[3- (prop- 2- en- 1- yloxy)phenyl]carbonyl}- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: C=CCOc1cccc(c1)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(C)cc1Cl

STK574889
Synonyms: 9- (4- chlorophenyl)- 6- (furan- 2- yl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Clc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccco1

STK574890
Synonyms: 3- (4- fluorobenzyl)- 8- (3- methoxyphenyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)F

STK574891
Synonyms: 2,5- dioxopyrrolidin- 1- ylN- {[(3R)- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindol- 3- yl]carbonyl}- L- alaninate
Smiles: O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C)ON1C(=O)CCC1=O

STK574892
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (naphthalen- 2- yl)ethanone
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)cccc3)nnc1COc1ccccc1

STK574893
Synonyms: 1- (3,4- dimethoxyphenyl)- 2- (prop- 2- en- 1- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: C=CCN1C(=O)c2c(C1c1ccc(c(c1)OC)OC)c(=O)c1c(o2)cccc1

STK574895
Synonyms: 3- [(3a'S,6a'R)- 6- chloro- 5'- cyclohexyl- 7- methyl- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]propanoicacid
Smiles: OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C1CCCCC1)C(=O)Nc1c2ccc(c1C)Cl

STK574897
Synonyms: 1- ethyl- 4- methyl- 6- (morpholin- 4- yl)- 2- oxo- 5- [(Z)- (4- oxo- 3- propyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 1,2- dihydropyridine- 3- carbonitrile
Smiles: CCCN1C(=S)S/C(=C\c2c(N3CCOCC3)n(CC)c(=O)c(c2C)C#N)/C1=O

STK574898
Synonyms: N- (4- {[(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl](pyridin- 3- ylmethyl)sulfamoyl}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N(Cc1cc2ccccc2[nH]c1=O)Cc1cccnc1

STK574899
Synonyms: (4E)- 1- [5- (ethylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 5- (4- fluorophenyl)- 4- [hydroxy(thiophen- 2- yl)methylidene]pyrrolidine- 2,3- dione
Smiles: CCSc1nnc(s1)N1C(c2ccc(cc2)F)/C(=C(/c2cccs2)\O)/C(=O)C1=O

STK574901
Synonyms: 2- amino- 4- (3- chlorophenyl)- 5- hydroxy- 7- methyl- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cccc(c1)Cl)c(O)nc(c2)C

STK574902
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)Cl

STK574903
Synonyms: N- (3- hydroxypropyl)- 5- methyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: OCCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CCC2

STK574904
Synonyms: N- [(2Z)- 3- [(2- methyl- 1,3- benzothiazol- 6- yl)amino]quinoxalin- 2(1H)- ylidene]- 2,3- dihydro- 1,4- benzodioxine- 6- sulfonamide
Smiles: Cc1sc2c(n1)ccc(c2)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1ccc2c(c1)OCCO2

STK574905
Synonyms: 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- (3- phenylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1CCCc1ccccc1)c(=O)n(c(=O)n2C)C

STK574906
Synonyms: N- (2- {6- [(E)- {2- [(4- bromophenyl)carbonyl]hydrazinylidene}methyl]- 7- methoxy- 1,3- benzodioxol- 5- yl}ethyl)- N- methylpropanamide
Smiles: CCC(=O)N(CCc1cc2OCOc2c(c1/C=N/NC(=O)c1ccc(cc1)Br)OC)C

STK574907
Synonyms: 7- methyl- 2- (4- methyl- 1,3- thiazol- 2- yl)- 1- (3- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1csc(n1)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)ccc(c1)C

STK574908
Synonyms: N- {1- [1- (4- chlorobenzyl)- 1H- benzimidazol- 2- yl]- 3- methyl- 1H- pyrazol- 5- yl}- 4- (trifluoromethoxy)benzamide
Smiles: Clc1ccc(cc1)Cn1c(nc2c1cccc2)n1nc(cc1NC(=O)c1ccc(cc1)OC(F)(F)F)C

STK574909
Synonyms: 2- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (4- sulfamoylbenzyl)acetamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)NCc1ccc(cc1)S(=O)(=O)N

STK574911
Synonyms: 7- (2- chlorobenzyl)- 6- hydroxy- 3- methyl- 8- [(4- methyl- 1,3- thiazol- 2- yl)sulfanyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1csc(n1)Sc1nc2c(n1Cc1ccccc1Cl)c(O)nc(=O)n2C

STK574912
Synonyms: ethyl4- [4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- yl]piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C

STK574913
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- chlorophenyl)carbonyl]- 2'- (pyridin- 4- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccncc1)C(=O)Nc1c2cccc1)cccc3

STK574915
Synonyms: (6E)- 5- imino- 6- [(4- oxo- 4H- chromen- 3- yl)methylidene]- 5,6- dihydro- 7H- [1,3]thiazolo[3,2- a]pyrimidin- 7- one
Smiles: O=C1N=c2sccn2C(=N)/C/1=C\c1coc2c(c1=O)cccc2

STK574916
Synonyms: 4- ({(E)- [4- (dimethylamino)phenyl]methylidene}amino)- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)N(C)C

STK574917
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- 5- (4- propoxyphenyl)- N'- [(E)- pyridin- 3- ylmethylidene]- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccnc1

STK574922
Synonyms: 7- [(2,4- dichlorobenzyl)sulfanyl]- 2- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: Clc1ccc(c(c1)Cl)CSc1nnc2n1c1sc3c(c1c1n2nc(n1)C)CCCC3

STK574924
Synonyms: (2E)- N- [(2Z)- 5- (benzylsulfonyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 3- phenylprop- 2- enamide
Smiles: O=C(/N=c\1/[nH]nc(s1)S(=O)(=O)Cc1ccccc1)/C=C/c1ccccc1

STK574926
Synonyms: 3'- tert- butyl- 6'- hydroxy- 3- phenyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: O=C1N=C(O)C2(C(=O)N1C(C)(C)C)Cc1ccccc1N1C2CN(CC1)c1ccccc1

STK574927
Synonyms: 6- hydroxy- 3- methyl- 7- (3- methylbenzyl)- 8- [(4- methyl- 1,3- thiazol- 2- yl)sulfanyl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: Cc1cccc(c1)Cn1c(Sc2scc(n2)C)nc2c1c(O)nc(=O)n2C

STK574929
Synonyms: 2- {[4- (furan- 2- ylmethyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1ccc(cc1)S(=O)(=O)N

STK574930
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK574933
Synonyms: 3- (1- oxo- 1- {4- [3- (trifluoromethyl)phenyl]piperazin- 1- yl}butan- 2- yl)quinazolin- 4(3H)- one
Smiles: CCC(n1cnc2c(c1=O)cccc2)C(=O)N1CCN(CC1)c1cccc(c1)C(F)(F)F

STK574934
Synonyms: 4- {[(E)- (2,4- dimethoxyphenyl)methylidene]amino}- 5- (3- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1OC)OC

STK574935
Synonyms: (4E)- 4- [hydroxy(phenyl)methylidene]- 5- (3- methoxyphenyl)- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: COc1cccc(c1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1nnc(s1)SC

STK574937
Synonyms: (8S,8aR,11aS)- 10- (3- chlorophenyl)- 9,11- dioxo- N- [3- (trifluoromethyl)phenyl]- 8a,9,10,11,11a,11b- hexahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinoline- 8- carboxamide
Smiles: Clc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)Nc2cccc(c2)C(F)(F)F)C=Cc2c1cccc2

STK574938
Synonyms: 3- ethyl- 1- methyl- 8- (2- methylphenyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1C

STK574939
Synonyms: 9- (4- fluorophenyl)- 6- (4- methoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccc(cc2)F)ncn3)C1)O

STK574940
Synonyms: (4E)- 2- (2,5- dimethoxyphenyl)- 4- {[(2,4- dimethoxyphenyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(c(c1)OC)N/C=C/1\c2ccccc2C(=O)N(C1=O)c1cc(OC)ccc1OC

STK574941
Synonyms: 6'- hydroxy- 2,4- dimethyl- 3'- (3- methylphenyl)- 8- nitro- 1,2,4,4a- tetrahydro- 2'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)c1cccc(c1)C)O)[N+](=O)[O-]

STK574942
Synonyms: 6- chloro- 3- [4- (diphenylmethyl)piperazin- 1- yl]- 4- phenylquinolin- 2- ol
Smiles: Clc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK574944
Synonyms: (3R,3'S,5'S)- 5- chloro- N- (4- methoxyphenyl)- 5'- (2- methylpropyl)- 2- oxo- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Cl)cc1)CC(C)C

STK574946
Synonyms: 3- butyl- 9- (4- fluorophenyl)- 1,7- dimethyl- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: CCCCn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)F

STK574947
Synonyms: 2- [(2- methyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidin- 7- yl)sulfanyl]- 1- phenylethanone
Smiles: Cc1nn2c(n1)c1c3CCCCc3sc1n1c2nnc1SCC(=O)c1ccccc1

STK574948
Synonyms: tert- butyl(3S)- 3- {[(2S)- 1- (cyclopentylamino)- 1- oxopropan- 2- yl]carbamoyl}- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: O=C([C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C)NC1CCCC1

STK574949
Synonyms: 3- benzyl- 1',3'- dimethyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H,7H- spiro[pyrido[1',2':1,2]pyrimido[5,4- c]quinolizine- 5,5'- pyrimidine]- 2',4',6',7(1'H,3'H)- tetrone
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(N3C2CC(CC3)Cc2ccccc2)nc2n(c1=O)cccc2

STK574950
Synonyms: 1'- (2,4- dimethylphenyl)- 8- nitro- 3- phenyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CN(CC1)c1ccccc1)[N+](=O)[O-]

STK574951
Synonyms: (1S,2S)- 2- phenyl- N'- [(E)- quinolin- 4- ylmethylidene]cyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1ccnc2c1cccc2

STK574952
Synonyms: 8- (3,5- dimethylphenyl)- 3- (3- hydroxypropyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: OCCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cc(C)cc(c1)C

STK574954
Synonyms: 2,8,10- trimethyl- 4- [4- (2- methylprop- 2- en- 1- yl)piperazin- 1- yl]pyrido[2',3':3,4]pyrazolo[1,5- a]pyrimidine
Smiles: CC(=C)CN1CCN(CC1)c1cc(C)nc2n1nc1c2c(C)cc(n1)C

STK574955
Synonyms: 1- (4- ethoxyphenyl)- 4- (4- methylphenyl)- N- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c(C(=O)Nc2ccccc2)n2c3c1CCCCn3c(c2)c1ccc(cc1)C

STK574956
Synonyms: 6- hydroxy- 1',6'- dimethyl- 3- (4- phenylbutan- 2- yl)- 1',4'- dihydro- 2H,2'H- spiro[pyrimidine- 5,3'- quinoline]- 2,4(3H)- dione
Smiles: Cc1ccc2c(c1)CC1(CN2C)C(=NC(=O)N(C1=O)C(CCc1ccccc1)C)O

STK574957
Synonyms: (5E)- 5- {1- [(1,3- benzodioxol- 5- ylmethyl)amino]ethylidene}- 3- cyclohexyl- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C(\NCc2ccc3c(c2)OCO3)/C)/C(=O)N1C1CCCCC1

STK574958
Synonyms: 4- (3- ethoxy- 4- hydroxyphenyl)- 1- (4- fluorophenyl)- 6- hydroxy- 3- methyl- 1H- pyrazolo[3,4- b]pyridine- 5- carbonitrile
Smiles: CCOc1cc(ccc1O)c1c(C#N)c(O)nc2c1c(C)nn2c1ccc(cc1)F

STK574960
Synonyms: (4E)- 2- (2,4- dimethylphenyl)- 4- {[(2- hydroxyethyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: OCCN/C=C/1\c2ccccc2C(=O)N(C1=O)c1ccc(cc1C)C

STK574961
Synonyms: (2'S,3S,3'S,10b'R)- 2'- {[4- (propan- 2- yloxy)phenyl]carbonyl}- 3'- (thiophen- 2- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CC(Oc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2cccs2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C

STK574963
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (1,3- benzodioxol- 5- ylcarbonyl)- 2'- (pyridin- 4- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccncc1)C(=O)Nc1c2cccc1)cccc3)c1ccc2c(c1)OCO2

STK574965
Synonyms: N'- [6- ethyl- 6- methyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]benzohydrazide
Smiles: CCC1(C)OCc2c(C1)c1c(NNC(=O)c3ccccc3)nc(nc1s2)SC

STK574967
Synonyms: 5- phenyl- 4- [(2E)- 2- (2,4,5- trimethoxybenzylidene)hydrazinyl]thieno[2,3- d]pyrimidine
Smiles: COc1cc(OC)c(cc1/C=N/Nc1ncnc2c1c(cs2)c1ccccc1)OC

STK574968
Synonyms: 1- tert- butyl4- (4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl)piperidine- 1,4- dicarboxylate
Smiles: O=C(C1CCN(CC1)C(=O)OC(C)(C)C)Oc1ccc2c(c1C)oc(=O)cc2C

STK574969
Synonyms: (5Z)- 5- benzylidene- 3- {2- oxo- 2- [2- (pyridin- 3- yl)piperidin- 1- yl]ethyl}- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: O=C(N1CCCCC1c1cccnc1)CN1C(=S)S/C(=C\c2ccccc2)/C1=O

STK574970
Synonyms: (5Z)- 1- (prop- 2- en- 1- yl)- 5- ({[2- (pyridin- 3- yl)piperidin- 1- yl]amino}methylidene)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: C=CCN1C(=NC(=O)/C(=C/NN2CCCCC2c2cccnc2)/C1=O)S

STK574971
Synonyms: (3aS,4R,4aS,7aR,8R,8aS)- 3,6- bis(4- methylphenyl)- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- epoxy[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: Cc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1O[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)C

STK574973
Synonyms: 6,6- dimethyl- 4- (2- methylpiperidin- 1- yl)- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidine
Smiles: CSc1nc(N2CCCCC2C)c2c(n1)sc1c2CC(OC1)(C)C

STK574974
Synonyms: 2- methoxy- N- [3- oxo- 2- (trifluoromethyl)- 2,3- dihydro- 1H- imidazo[1,2- a]benzimidazol- 2- yl]benzamide
Smiles: COc1ccccc1C(=O)NC1(Nc2n(C1=O)c1c(n2)cccc1)C(F)(F)F

STK574975
Synonyms: 7- chloro- 1- (4- ethoxyphenyl)- 6- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C

STK574976
Synonyms: 4- {[(E)- (2- chloro- 5- nitrophenyl)methylidene]amino}- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1cc(ccc1Cl)[N+](=O)[O-]

STK574978
Synonyms: 5- (3- chlorophenyl)- 4- {[(E)- (2- methylphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1C

STK574979
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(4- methylphenyl)carbonyl]- 3'- {[4- (propan- 2- yloxy)phenyl]carbonyl}- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CC(Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)C)C(=O)Nc1c2cccc1)cccc3)C

STK574982
Synonyms: 2- {[4- (2,5- dimethoxyphenyl)- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 3- yl]methyl}phthalazin- 1(2H)- one
Smiles: COc1ccc(cc1n1c(=S)[nH]nc1Cn1ncc2c(c1=O)cccc2)OC

STK574983
Synonyms: N- (1- benzylpiperidin- 4- yl)- 3- (7- hydroxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)propanamide
Smiles: O=C(NC1CCN(CC1)Cc1ccccc1)CCc1c(=O)oc2c(c1C)ccc(c2C)O

STK574985
Synonyms: (3a'S,6a'R)- 3'- benzyl- 5'- butyl- 7- chloro- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccccc2)C(=O)Nc2c1cccc2Cl

STK574986
Synonyms: N- [4- (diethylamino)phenyl]- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCN(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1)CC

STK574987
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,5- dimethylphenyl)acetamide
Smiles: O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK574990
Synonyms: 3- amino- N- (2,3- dimethoxybenzyl)- 6- (thiophen- 2- yl)thieno[2,3- b]pyridine- 2- carboxamide
Smiles: COc1c(cccc1OC)CNC(=O)c1sc2c(c1N)ccc(n2)c1cccs1

STK574992
Synonyms: 5- (2- bromophenyl)- 4- {[(E)- (3,5- dibromo- 2- hydroxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1cc(/C=N/n2c(=S)[nH]nc2c2ccccc2Br)c(c(c1)Br)O

STK574993
Synonyms: 6,8- dibromo- N- (3,4- dimethoxybenzyl)- 2,4- dihydroxyquinoline- 3- carboxamide
Smiles: COc1ccc(cc1OC)CNC(=O)c1c(O)nc2c(c1O)cc(cc2Br)Br

STK574994
Synonyms: 10,10- dimethyl- 2- (piperidin- 1- ylmethyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(s2)ncn2c1nc(n2)CN1CCCCC1

STK574996
Synonyms: (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)(2- nitrophenyl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccccc1[N+](=O)[O-]

STK574997
Synonyms: N- (2,2- dimethoxyethyl)- 8- ethoxy- 5H- pyrimido[5,4- b]indol- 4- amine
Smiles: CCOc1ccc2c(c1)c1ncnc(c1[nH]2)NCC(OC)OC

STK574998
Synonyms: 1- [10- (3,4- dimethoxyphenyl)- 8- methyl- 2- phenyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl]ethanone
Smiles: COc1cc(ccc1OC)C1C(=C(C)Oc2c1c1nc(nn1cn2)c1ccccc1)C(=O)C

STK575000
Synonyms: 5- (4- chlorophenyl)- 1,3- dimethyl- 10- (thiophen- 2- yl)- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Clc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1cccs1

STK575001
Synonyms: 5- (3- methoxyphenyl)- 4- {[(E)- (2,4,6- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1c(OC)cc(cc1OC)OC

STK575002
Synonyms: 7'- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2CCC1)n1c(C)ccc1C

STK575003
Synonyms: 3- [(2,4- dichlorobenzyl)sulfanyl]- 5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2Cl)Cl)nnc1c1cccc(c1)C

STK575005
Synonyms: 3- [(3a'S,6a'R)- 5'- tert- butyl- 5- fluoro- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]propanamide
Smiles: NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cc(F)cc1

STK575006
Synonyms: N- [3- (1,3- benzodioxol- 5- yl)- 1- methyl- 4- oxo- 1,4- dihydroquinolin- 2- yl]- 3,4,5- trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)Nc1c(c2ccc3c(c2)OCO3)c(=O)c2c(n1C)cccc2

STK575008
Synonyms: N- [3- (dimethylamino)propyl]- 2- [(3- methyl- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 1- yl)oxy]acetamide
Smiles: CN(CCCNC(=O)COc1cc(C)cc2c1c1CCCCc1c(=O)o2)C

STK575009
Synonyms: 3- (3- chlorophenyl)- 7- methyl- 2- [(2- phenylethyl)amino]- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(n1)NCCc1ccccc1)c1cccc(c1)Cl

STK575010
Synonyms: (2- chlorophenyl){4- [(1- methyl- 5- nitro- 1H- benzimidazol- 2- yl)methyl]piperazin- 1- yl}methanone
Smiles: Clc1ccccc1C(=O)N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)[N+](=O)[O-]

STK575011
Synonyms: N- [(2Z)- 3- (3,4- dimethoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methoxyacetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1Cc1ccc(c(c1)OC)OC)CS(=O)(=O)C2

STK575012
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2,4- dimethoxyphenyl)carbonyl]- 3'- [(4- methylphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(c(c1)OC)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK575013
Synonyms: methylN- {(1E)- 1- [4- hydroxy- 1- (4- methoxyphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]propyl}tryptophanate
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)OC)O)/NC(C(=O)OC)Cc1c[nH]c2c1cccc2

STK575014
Synonyms: 1- (2,5- dimethoxyphenyl)- 2- (6- methyl- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(c(c1)C1N(c2nc3c(s2)cc(cc3)C)C(=O)c2c1c(=O)c1c(o2)cccc1)OC

STK575016
Synonyms: N- [(2S)- 3- methyl- 1- oxo- 1- (propylamino)butan- 2- yl]- 2,3- dihydro- 1H- imidazo[1,2- a]benzimidazole- 1- carboxamide
Smiles: CCCNC(=O)[C@H](C(C)C)NC(=O)N1CCn2c1nc1c2cccc1

STK575017
Synonyms: 2- (5- methoxy- 4,7- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- (pyridin- 3- ylmethyl)acetamide
Smiles: COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)NCc1cccnc1

STK575018
Synonyms: 3- [4- (4- bromophenoxy)butyl]- 2- (4- methoxyphenyl)quinazolin- 4(3H)- one
Smiles: COc1ccc(cc1)c1nc2ccccc2c(=O)n1CCCCOc1ccc(cc1)Br

STK575019
Synonyms: 2- [(2,6- dimethylphenoxy)methyl]- 11- (furan- 2- yl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nn(c2c1C(c1ccco1)c1c(O2)ncn2c1nc(n2)COc1c(C)cccc1C)c1ccccc1

STK575020
Synonyms: 4- bromo- N'- [(E)- (2- chloro- 6- methoxyquinolin- 3- yl)methylidene]benzohydrazide
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)/C=N/NC(=O)c1ccc(cc1)Br

STK575021
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- (4- chlorophenyl)- 6- cyclohexyl- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: Clc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)C1CCCCC1

STK575022
Synonyms: 2- {[5- (2- chlorophenyl)- 4- (4- ethoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,3- dimethylphenyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)C)nnc1c1ccccc1Cl

STK575023
Synonyms: 7- benzyl- 8- {[4- (4- methoxyphenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK575024
Synonyms: 2- (benzylsulfanyl)- 9- (3- ethoxy- 4- hydroxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCOc1cc(ccc1O)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1

STK575025
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[5- (2- methylphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)C(CC)C)nnc1c1ccccc1C

STK575026
Synonyms: methyl[8- (4- butylphenyl)- 1- methyl- 2,4- dioxo- 1,2,4,6,7,8- hexahydro- 3H- imidazo[2,1- f]purin- 3- yl]acetate
Smiles: CCCCc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)OC

STK575029
Synonyms: 2- [(5Z)- 4- oxo- 5- (pyridin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoicacid
Smiles: OC(=O)C(N1C(=S)S/C(=C\c2ccccn2)/C1=O)C

STK575030
Synonyms: 7- chloro- 1- (4- methoxyphenyl)- 2- (2- phenylethyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1)C1N(CCc2ccccc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK575031
Synonyms: 4- {[(E)- anthracen- 9- ylmethylidene]amino}- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1c2ccccc2cc2c1cccc2

STK575032
Synonyms: propyl4- {[6- (4- acetyl- 5- methyl- 1H- pyrazol- 1- yl)- 2- methylpyrimidin- 4- yl]oxy}benzoate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1nc(C)nc(c1)n1ncc(c1C)C(=O)C

STK575035
Synonyms: (4Z)- 2- (thiophen- 2- yl)- 4- [2- (3,4,5- trimethoxyphenyl)- 4H- chromen- 4- ylidene]- 1,3- oxazol- 5(4H)- one
Smiles: COc1cc(cc(c1OC)OC)C1=C/C(=C\2/N=C(OC2=O)c2cccs2)/c2c(O1)cccc2

STK575037
Synonyms: 2- (6- chloro- 7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (2,2,6,6- tetramethylpiperidin- 4- yl)acetamide
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NC1CC(C)(C)NC(C1)(C)C

STK575039
Synonyms: N- (3- methoxyphenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccccc1)c1ccccn1

STK575040
Synonyms: 2- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 5- hydroxy- 4- (4- methoxyphenyl)- 7,7- dimethyl- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccc(cc2)Cl)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)OC

STK575041
Synonyms: 3- nitro- 6,12- dioxo- 4b,6,7,8a,9,10,10a,10b,11,12- decahydro- 9,11- methano- 13- oxa- 5,8- dithia- 7- azabenzo[4,5]cycloocta[1,2,3- cd]- s- indacene- 14- carboxylicacid
Smiles: O=C1Oc2ccc(cc2C2C3C4C1C(C(=O)O)C(C4)C3Sc1c2sc(=O)[nH]1)[N+](=O)[O-]

STK575045
Synonyms: N- [4- (6- oxo- 7,8,9,10- tetrahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 3(4H)- yl)phenyl]acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1COc2c(C1)c1oc(=O)c3c(c1cc2)CCCC3

STK575046
Synonyms: 2- (ethylsulfanyl)- 9- (4- hydroxy- 3- methoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nn2c(n1)N=C1C(=C(O)CCC1)C2c1ccc(c(c1)OC)O

STK575047
Synonyms: 4- {[(E)- (4- methoxyphenyl)methylidene]amino}- 5- [3- (propan- 2- yloxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(C)C

STK575048
Synonyms: 1- (4- ethoxyphenyl)- 2- (6- methoxy- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK575051
Synonyms: N- [1- benzyl- 4,6- dioxo- 2- sulfanyl- 5- (trifluoromethyl)- 4,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]- 4- fluorobenzamide
Smiles: Fc1ccc(cc1)C(=O)NC1(C(=O)Nc2c1c(=O)nc(n2Cc1ccccc1)S)C(F)(F)F

STK575054
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- fluorophenyl)acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1COc1ccccc1

STK575056
Synonyms: 4- {(2E)- 2- [(1- phenyl- 1H- pyrrol- 2- yl)methylidene]hydrazinyl}benzoicacid
Smiles: OC(=O)c1ccc(cc1)N/N=C/c1cccn1c1ccccc1

STK575057
Synonyms: 2- (4- chlorophenyl)- 3- [(3- chlorophenyl)sulfonyl]- 9,10- dimethoxy- 6,7- dihydro- 2H- pyrido[2,1- a]isoquinolin- 4- amine
Smiles: COc1cc2c(cc1OC)CCN1C2=CC(c2ccc(cc2)Cl)C(=C1N)S(=O)(=O)c1cccc(c1)Cl

STK575058
Synonyms: 2- {[7,7- dimethyl- 2- (4- methylphenyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: Cc1ccc(cc1)c1nc(SCC(=O)N(c2ccccc2)c2ccccc2)c2c(n1)CC(OC2)(C)C

STK575059
Synonyms: 2- {[4- amino- 5- (5- phenyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- fluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccccc1

STK575060
Synonyms: 3- (2,4- dichlorobenzyl)- 8- (2- methoxyphenyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: COc1ccccc1N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1Cl)Cl

STK575062
Synonyms: tert- butyl(3S)- 3- {[(2S)- 1- (cyclohexylamino)- 3- methyl- 1- oxobutan- 2- yl]carbamoyl}- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: CC([C@@H](C(=O)NC1CCCCC1)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C)C

STK575064
Synonyms: 1,3- dimethyl- 8- [(3- methylpiperidin- 1- yl)methyl]- 7- [2- (morpholin- 4- yl)ethyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCCN(C1)Cc1nc2c(n1CCN1CCOCC1)c(=O)n(c(=O)n2C)C

STK575067
Synonyms: 11- methyl- N- [3- (propan- 2- yloxy)propyl]- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CC(OCCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1C(C)CCC2)C

STK575069
Synonyms: N'- [(E)- (2- hydroxy- 3- methoxyphenyl)methylidene]- 5- methoxy- 1H- indole- 2- carbohydrazide
Smiles: COc1ccc2c(c1)cc([nH]2)C(=O)N/N=C/c1cccc(c1O)OC

STK575071
Synonyms: 2- {[4- (furan- 2- ylmethyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4,6- trimethylphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1Cc1ccco1)SCC(=O)Nc1c(C)cc(cc1C)C

STK575072
Synonyms: (2Z)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 1(2H)- ylidene)- 1- (4- methoxy- 3- nitrophenyl)ethanone
Smiles: COc1cc2CCN/C(=C\C(=O)c3ccc(c(c3)[N+](=O)[O-])OC)/c2cc1OC

STK575073
Synonyms: N- {[1- (tert- butoxycarbonyl)- 4- phenylpiperidin- 4- yl]carbonyl}- L- valine
Smiles: CC([C@@H](C(=O)O)NC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)C

STK575074
Synonyms: 3- (2- chlorophenyl)- 5- [(4- fluorobenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)n1c(SCc2ccc(cc2)F)nnc1c1ccccc1Cl

STK575075
Synonyms: 1- (2- chloro- 5- nitrophenyl)hexahydro- 3H- pyrido[1,2- c][1,3]oxazine
Smiles: Clc1ccc(cc1C1OCCC2N1CCCC2)[N+](=O)[O-]

STK575076
Synonyms: 2- ethyl- 1- (4- nitrophenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCN1C(=O)c2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)c1c(o2)cccc1

STK575078
Synonyms: 5- {[3- methoxy- 4- (thiophen- 2- ylmethoxy)benzyl]amino}- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: COc1cc(CNc2ccc(c(c2)C(=O)[O-])[NH+]2CCOCC2)ccc1OCc1cccs1

STK575079
Synonyms: 8- (4- chlorophenyl)- 2,11- bis(2- methoxyphenyl)- 10- methyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccccc1OC)c1ccc(cc1)Cl

STK575080
Synonyms: dimethyl(1,1- dioxidotetrahydrothiophen- 3- yl)phosphonate
Smiles: COP(=O)(C1CCS(=O)(=O)C1)OC

STK575081
Synonyms: 2- benzyl- 14- phenyl- 14H- benzo[7,8]chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: c1ccc(cc1)C1c2c(ncn3c2nc(n3)Cc2ccccc2)Oc2c1ccc1c2cccc1

STK575083
Synonyms: 2- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)- N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)acetamide
Smiles: COc1cc2c(cc1OC)CCN(C2C)CC(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C

STK575084
Synonyms: 2- {[5- (4- fluorophenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2)S(=O)(=O)N)nnc1c1ccc(cc1)F

STK575085
Synonyms: 3- (pyridin- 2- ylmethyl)- 3,4,7,8,9,10- hexahydro- 2H,6H- benzo[3,4]chromeno[8,7- e][1,3]oxazin- 6- one
Smiles: O=c1oc2c3CN(COc3ccc2c2c1CCCC2)Cc1ccccn1

STK575086
Synonyms: N- (naphthalen- 1- yl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc2c1cccc2)CSc1nnc(n1c1ccccc1)c1nccnc1

STK575087
Synonyms: N- (3- fluorophenyl)- 2- {[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2)F)nnc1c1cccc(c1)C

STK575088
Synonyms: 9- (3- chlorophenyl)- 10- [(3- methoxypropyl)amino]- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 8(9H)- one
Smiles: COCCCNc1nc2c3c(sc2c(=O)n1c1cccc(c1)Cl)nc(c1c3CC(C)(C)OC1)C

STK575089
Synonyms: (3R)- N- {(2S)- 1- [(furan- 2- ylmethyl)amino]- 3- methyl- 1- oxobutan- 2- yl}- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: CC([C@@H](C(=O)NCc1ccco1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK575090
Synonyms: ethyl4- ({1,3- dimethyl- 7- [2- (morpholin- 4- yl)ethyl]- 2,6- dioxo- 2,3,6,7- tetrahydro- 1H- purin- 8- yl}methyl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)Cc1nc2c(n1CCN1CCOCC1)c(=O)n(c(=O)n2C)C

STK575094
Synonyms: 1,7- dimethyl- 3- [2- (morpholin- 4- yl)ethyl]- 8- (2- phenylethyl)- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Cc1cn2c(n1CCc1ccccc1)nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK575095
Synonyms: N- [(2,5- dichlorophenyl)carbamoyl]- D- alanine
Smiles: C[C@H](C(=O)O)NC(=O)Nc1cc(Cl)ccc1Cl

STK575096
Synonyms: N- (2- ethyl- 6- methylphenyl)- 2- {[5- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2CC)nnc1c1cccc(c1)OC

STK575099
Synonyms: N- (3- methoxyphenyl)- 4- (4- methylphenyl)- 1- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccccc1)CCCC3)c1ccc(cc1)C

STK575101
Synonyms: 11- hexyl- 2- methyl- 3- propyl- 3,11- dihydro- 4H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 4- one
Smiles: CCCCCCn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)CCC

STK575102
Synonyms: (3aR,6aS)- 3- (2,5- dimethoxyphenyl)- 5- (2,6- dimethylphenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1ccc(cc1C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1c(C)cccc1C)OC

STK575103
Synonyms: 5- {3- [(2- chlorobenzyl)oxy]phenyl}- N'- [(1E,2E)- 3- phenylprop- 2- en- 1- ylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1Cl)N/N=C/C=C/c1ccccc1

STK575104
Synonyms: 2- ({4- [4- (benzyloxy)phenyl]- 3- cyano- 6- hydroxy- 4,5- dihydropyridin- 2- yl}sulfanyl)- N- (4- methoxyphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)OC)N=C(CC1c1ccc(cc1)OCc1ccccc1)O

STK575105
Synonyms: 3- [2- (cyclohex- 1- en- 1- yl)ethyl]- 5- [(2E)- 3- (3,4- dimethoxyphenyl)prop- 2- enoyl]- 2,6- dihydroxypyrimidin- 4(3H)- one
Smiles: COc1cc(/C=C/C(=O)c2c(O)nc(n(c2=O)CCC2=CCCCC2)O)ccc1OC

STK575106
Synonyms: 2'- hydroxy- 12- methyl- 1'- (2- phenylethyl)- 15,16- dihydro- 4'H,4bH,6H,7H- spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1- a]isoquinoline- 5,5'- pyrimidine]- 4',6',7(1'H)- trione
Smiles: OC1=NC(=O)C2(C(=O)N1CCc1ccccc1)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C

STK575108
Synonyms: 5- (2- fluorophenyl)- 4- ({(E)- [4- (methylsulfanyl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CSc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK575109
Synonyms: ethyl4- [(8S,8aR,11aS)- 9,11- dioxo- 8- (phenylcarbonyl)- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinolin- 10(11H)- yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@H](N1C2c2ccccc2C=C1)C(=O)c1ccccc1

STK575111
Synonyms: 7- (2- chloro- 6- fluorobenzyl)- 1,3- dimethyl- 8- [(2- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCCCN1Cc1nc2c(n1Cc1c(F)cccc1Cl)c(=O)n(c(=O)n2C)C

STK575112
Synonyms: N- [2- (4- chlorophenyl)- 4- (4- methoxyphenyl)- 6- methyl- 5- oxo- 2,5- dihydropyridazin- 3- yl]- 2- fluorobenzamide
Smiles: COc1ccc(cc1)c1c(NC(=O)c2ccccc2F)n(nc(c1=O)C)c1ccc(cc1)Cl

STK575113
Synonyms: 2- [(4- benzylpiperazin- 1- yl)carbonyl]- 3,6,6- trimethyl- 6,7- dihydro- 1- benzofuran- 4(5H)- one
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)N1CCN(CC1)Cc1ccccc1

STK575116
Synonyms: 5- (3- bromophenyl)- 4- (2- methylprop- 2- en- 1- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CC(=C)Cn1c(=S)[nH]nc1c1cccc(c1)Br

STK575117
Synonyms: 3- [(4- bromobenzyl)sulfanyl]- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 4- amine
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCc1ccc(cc1)Br

STK575118
Synonyms: 3- [(2,6- dichlorobenzyl)sulfanyl]- 5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazole
Smiles: COc1ccc(cc1)n1c(nnc1c1ccccc1F)SCc1c(Cl)cccc1Cl

STK575119
Synonyms: 2- (6- fluoro- 1,3- benzothiazol- 2- yl)- 1- (pyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Fc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1ccccn1)c(=O)c1c(o2)cccc1

STK575120
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[3- (4- chlorophenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Cl)C

STK575124
Synonyms: 3- phenyl- 5- (propan- 2- yl)- 7- (pyrrolidin- 1- yl)pyrazolo[1,5- a]pyrimidine
Smiles: CC(c1cc(N2CCCC2)n2c(n1)c(cn2)c1ccccc1)C

STK575125
Synonyms: N- [6- chloro- 3- (4- methoxyphenyl)- 4- oxo- 4H- chromen- 2- yl]- 4- fluorobenzamide
Smiles: COc1ccc(cc1)c1c(NC(=O)c2ccc(cc2)F)oc2c(c1=O)cc(cc2)Cl

STK575126
Synonyms: 2,6- dihydroxy- 7'- nitro- 2'- phenyl- 1',2',3',3a'- tetrahydro- 4H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinolin]- 4- one
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N1C2CC(C1)c1ccccc1)[N+](=O)[O-]

STK575127
Synonyms: 7- (4- methoxyphenyl)- 2- methyl- 5- (naphthalen- 2- yl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: COc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)C)c1ccc2c(c1)cccc2

STK575128
Synonyms: N- (propan- 2- ylcarbamoyl)- D- leucine
Smiles: CC(C[C@H](C(=O)O)NC(=O)NC(C)C)C

STK575129
Synonyms: (4E)- 1- (5- acetyl- 4- methyl- 1,3- thiazol- 2- yl)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (3- ethoxy- 4- propoxyphenyl)pyrrolidine- 2,3- dione
Smiles: CCCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc(c(n1)C)C(=O)C

STK575130
Synonyms: (4E)- 5- (4- chlorophenyl)- 1- (4- fluorophenyl)- 4- [hydroxy(phenyl)methylidene]pyrrolidine- 2,3- dione
Smiles: Clc1ccc(cc1)C1/C(=C(/c2ccccc2)\O)/C(=O)C(=O)N1c1ccc(cc1)F

STK575134
Synonyms: 3- hydroxy- 2- [(2E)- 2- (pyridin- 4- ylmethylidene)hydrazinyl]quinazolin- 4(3H)- one
Smiles: On1c(N/N=C/c2ccncc2)nc2c(c1=O)cccc2

STK575135
Synonyms: 5- methyl- 3- [2- (morpholin- 4- yl)ethyl]- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: Cn1c2ccccc2c2c1c(=O)n(CCN1CCOCC1)cn2

STK575136
Synonyms: (3R,3'S,5'R)- 7- chloro- N- (4- methoxyphenyl)- 5- methyl- 2- oxo- 5'- (propan- 2- yl)- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(C)cc1Cl)C(C)C

STK575138
Synonyms: 8- [4- (2,4- dichlorobenzyl)piperazin- 1- yl]- 6- hydroxy- 7- (2- methoxyethyl)- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: COCCn1c(nc2c1c(O)nc(=O)n2C)N1CCN(CC1)Cc1ccc(cc1Cl)Cl

STK575139
Synonyms: 2- ({6- cyano- 8,8- dimethyl- 5- [(4- methylphenyl)amino]- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridin- 3- yl}sulfanyl)- N- (4- methylphenyl)acetamide
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccc(cc1)C)c(SCC(=O)Nc1ccc(cc1)C)nn2

STK575140
Synonyms: 3- (3- chlorophenyl)- 2- {[3- (diethylamino)propyl]amino}- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: CCN(CCCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCN(C3)C)CC

STK575141
Synonyms: N- (2,2- dimethoxyethyl)- 4- (propan- 2- yl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- amine
Smiles: COC(CNc1ncnc2c1oc1c2c2CCCc2c(n1)C(C)C)OC

STK575142
Synonyms: 2- (6- methoxy- 1,3- benzothiazol- 2- yl)- 1- (4- methoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)OC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK575144
Synonyms: 1- methyl- 3- (3- methylbutyl)- 8- phenyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CC(CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1)C

STK575146
Synonyms: N- (2- ethylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK575147
Synonyms: 3- benzyl- 1'- (2- methoxyethyl)- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: COCCN1C(=O)NC(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)Cc1ccccc1

STK575148
Synonyms: 4- {[(2Z)- 3- [2- (3,4- dimethoxyphenyl)ethyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]amino}- 4- oxobutanoicacid
Smiles: COc1cc(CCN2/C(=N/C(=O)CCC(=O)O)/SC3C2CS(=O)(=O)C3)ccc1OC

STK575149
Synonyms: 1- (1,1,1,3,3,3- hexafluoro- 2- methylpropan- 2- yl)- 3- (4H- 1,2,4- triazol- 4- yl)urea
Smiles: O=C(NC(C(F)(F)F)(C(F)(F)F)C)Nn1cnnc1

STK575150
Synonyms: 2,2,5- trimethyl- N- [3- (morpholin- 4- yl)propyl]- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- amine
Smiles: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCCCN1CCOCC1

STK575151
Synonyms: (5Z)- 3- (4- chlorophenyl)- 6- hydroxy- 5- (5- phenylpyrazolidin- 3- ylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C\2/NNC(C2)c2ccccc2)/C1=O)O

STK575152
Synonyms: N- [(4,11- dimethyl- 2- oxo- 6,7,8,9- tetrahydro- 2H- [1]benzofuro[3,2- g]chromen- 3- yl)acetyl]norvalyl- N~5~- carbamoyl- D- ornithine
Smiles: CCCC(C(=O)N[C@@H](C(=O)O)CCCNC(=O)N)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2C)oc2c1CCCC2

STK575155
Synonyms: (3R,3'S,5'S)- 5- chloro- N- (2,5- dimethoxyphenyl)- 7- methyl- 5'- (2- methylpropyl)- 2- oxo- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(cc1NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Cl)cc1C)CC(C)C)OC

STK575156
Synonyms: 3- benzyl- 2,6- dihydroxy- 5- (3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)pyrimidin- 4(3H)- one
Smiles: O=C1OC(c2c1cccc2)c1c(O)nc(n(c1=O)Cc1ccccc1)O

STK575158
Synonyms: 3- (4- chlorophenyl)- 7- hydrazinyl- 5- phenylpyrazolo[1,5- a]pyrimidine
Smiles: NNc1cc(nc2n1ncc2c1ccc(cc1)Cl)c1ccccc1

STK575159
Synonyms: 7- (3- hydroxypropyl)- 1,3- dimethyl- 8- [(4- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: OCCCn1c(CN2CCC(CC2)C)nc2c1c(=O)n(c(=O)n2C)C

STK575160
Synonyms: 1- (3- acetyl- 1',3'- dimethyl- 2',4',6'- trioxo- 1',2,3,3',4,4',4a,6'- octahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 8- yl)- 3- phenylurea
Smiles: O=C(Nc1ccccc1)Nc1ccc2c(c1)CC1(C3N2CCN(C3)C(=O)C)C(=O)N(C)C(=O)N(C1=O)C

STK575161
Synonyms: (3R,3'S,3a'S,6a'R)- 5'- (2,4- dichlorophenyl)- 3'- [2- (methylsulfanyl)ethyl]- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CSCC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(cc1Cl)Cl)C(=O)Nc1c2cccc1

STK575162
Synonyms: 3- (4- bromophenyl)- 2- {[2- (3- methoxyphenyl)- 2- oxoethyl]sulfanyl}quinazolin- 4(3H)- one
Smiles: COc1cccc(c1)C(=O)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Br

STK575163
Synonyms: 8- (2- methoxyphenyl)- 1- methyl- 3- (prop- 2- en- 1- yl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: C=CCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1ccccc1OC

STK575165
Synonyms: (4E)- 1- (4- fluorophenyl)- 4- [hydroxy(4- methylphenyl)methylidene]- 5- phenylpyrrolidine- 2,3- dione
Smiles: Cc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1ccc(cc1)F)/O

STK575166
Synonyms: tert- butyl{(2S)- 4- methyl- 1- oxo- 1- [(2E)- 2- (quinoxalin- 6- ylmethylidene)hydrazinyl]pentan- 2- yl}carbamate(non- preferredname)
Smiles: CC(C[C@@H](C(=O)N/N=C/c1ccc2c(c1)nccn2)NC(=O)OC(C)(C)C)C

STK575168
Synonyms: 2- (2- methoxyphenyl)- 5- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccccc1c1nn2c(n1)c1c(nc2C)sc2c1CCCC2

STK575169
Synonyms: 3- (4- chlorobenzyl)- 8- (4- ethoxyphenyl)- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Cl

STK575170
Synonyms: 4- {[(E)- (4- chlorophenyl)methylidene]amino}- 5- (3- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)Cl

STK575171
Synonyms: 5- {4- [(2- chlorobenzyl)oxy]phenyl}- N'- [(E)- (2- hydroxynaphthalen- 1- yl)methylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(cc1)OCc1ccccc1Cl)N/N=C/c1c(O)ccc2c1cccc2

STK575172
Synonyms: 3- [(2S)- 1- (azepan- 1- yl)- 1- oxopropan- 2- yl]quinazolin- 4(3H)- one
Smiles: O=C([C@@H](n1cnc2c(c1=O)cccc2)C)N1CCCCCC1

STK575174
Synonyms: 5- {4- [(4- chlorobenzyl)oxy]phenyl}- N'- {(E)- [4- (dimethylamino)phenyl]methylidene}- 1H- pyrazole- 3- carbohydrazide
Smiles: Clc1ccc(cc1)COc1ccc(cc1)c1[nH]nc(c1)C(=O)N/N=C/c1ccc(cc1)N(C)C

STK575175
Synonyms: 3- (1H- benzimidazol- 1- yl)- N- (2- methoxyphenyl)propanamide
Smiles: COc1ccccc1NC(=O)CCn1cnc2c1cccc2

STK575179
Synonyms: N- [(2Z)- 3- (2- fluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]butanamide
Smiles: CCCC(=O)/N=C/1\SC2C(N1c1ccccc1F)CS(=O)(=O)C2

STK575180
Synonyms: 4- {[(E)- (2- chlorophenyl)methylidene]amino}- 5- (3- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccccc1Cl

STK575181
Synonyms: 3- (2- fluorophenyl)tetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- imine5,5- dioxide
Smiles: N=C1SC2C(N1c1ccccc1F)CS(=O)(=O)C2

STK575182
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- ({4- (4- ethoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1COc1ccc(cc1)C

STK575184
Synonyms: 2- {[4- amino- 5- (5- methyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dichlorophenyl)acetamide
Smiles: O=C(Nc1cc(Cl)ccc1Cl)CSc1nnc(n1N)c1n[nH]c(c1)C

STK575185
Synonyms: N- (2,4- dimethylphenyl)- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: O=C(Nc1ccc(cc1C)C)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK575186
Synonyms: N,N- dimethyl- N'- (8- propyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)ethane- 1,2- diamine
Smiles: CCCN1CCc2c(C1)sc1c2c(NCCN(C)C)nc2n1nnn2

STK575187
Synonyms: 9- chloro- 5- (3- fluorophenyl)- 2- (3- methoxyphenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1cccc(c1)C1=NN2C(C1)c1cc(Cl)ccc1OC2c1cccc(c1)F

STK575190
Synonyms: 5- {4- [(2- chlorobenzyl)oxy]phenyl}- N'- [(1E)- 1- (3,4- dichlorophenyl)ethylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc(cc1)OCc1ccccc1Cl)N/N=C(/c1ccc(c(c1)Cl)Cl)\C

STK575191
Synonyms: N- (9- ethyl- 9H- carbazol- 3- yl)- 2- {[4- ethyl- 5- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc3c(c2)c2ccccc2n3CC)nnc1c1ccc(cc1)C

STK575193
Synonyms: N- (3,5- dimethoxyphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2c2ccc(cc2)C)c2ccccn2)cc(c1)OC

STK575194
Synonyms: 6- (2- methylphenyl)- 6H- benzo[b]indeno[1,2- e][1,4]thiazepin- 5- ol
Smiles: Cc1ccccc1C1Sc2ccccc2N=C2C1=C(O)c1c2cccc1

STK575199
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: COc1cc(CCNC(=O)c2nn3c(n2)c2c(nc3C)sc3c2CC(C)(C)OC3)ccc1OC

STK575200
Synonyms: (E)- 2,3- dihydro- 1,4- benzodioxin- 6- yl{1- [2- (dimethylammonio)ethyl]- 2- (3- ethoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

STK575202
Synonyms: N- {4- [(3a'S,6a'R)- 3'- (1H- indol- 3- ylmethyl)- 7- methyl- 2,4',6'- trioxo- 1,2,2',3',3a',4',6',6a'- octahydro- 5'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 5'- yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2C

STK575203
Synonyms: (3S)- N- {2- [(4- methylbenzyl)amino]- 2- oxoethyl}- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: O=C(NCc1ccc(cc1)C)CNC(=O)[C@H]1NCc2c(C1)cccc2

STK575204
Synonyms: 4- (4- ethylpiperazin- 1- yl)- 1- methyl- 3- nitroquinolin- 2(1H)- one
Smiles: CCN1CCN(CC1)c1c([N+](=O)[O-])c(=O)n(c2c1cccc2)C

STK575205
Synonyms: 4- imino- 2- phenyl- 6,7,11,12- tetrahydro- 4H,10H- [1,4]dioxepino[2,3- g]pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCCCOc2c1)c1ccccc1

STK575206
Synonyms: 12- (4- methoxyphenyl)- 2- [(naphthalen- 1- yloxy)methyl]- 12H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- ol
Smiles: COc1ccc(cc1)C1c2ccc(cc2Oc2c1c1nc(nn1cn2)COc1cccc2c1cccc2)O

STK575207
Synonyms: 3- (3- chlorophenyl)- 2,10- dimethylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: Clc1cccc(c1)n1c(C)nc2c(c1=O)c(=O)c1c(n2C)cccc1

STK575208
Synonyms: (4E)- 1- [5- (benzylsulfanyl)- 1,3,4- thiadiazol- 2- yl]- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [3- ethoxy- 4- (prop- 2- en- 1- yloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: C=CCOc1ccc(cc1OCC)C1N(c2nnc(s2)SCc2ccccc2)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK575209
Synonyms: (3a'S,6a'R)- 5- fluoro- 3'- (2- methylpropyl)- 5'- (2- phenylethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CC(CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cc(F)cc1)C

STK575210
Synonyms: (4E)- 5- (4- ethoxyphenyl)- 4- [furan- 2- yl(hydroxy)methylidene]- 1- [5- (methylsulfanyl)- 1,3,4- thiadiazol- 2- yl]pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1)C1/C(=C(/c2ccco2)\O)/C(=O)C(=O)N1c1nnc(s1)SC

STK575211
Synonyms: 6- (2- phenylethyl)- 2- sulfanyl- 1- [3- (trifluoromethyl)phenyl]- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(S)n(c2c1CN(CN2)CCc1ccccc1)c1cccc(c1)C(F)(F)F

STK575212
Synonyms: 1- methyl- 8- (3- methylphenyl)- 3- [2- (morpholin- 4- yl)ethyl]- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Cc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCOCC1

STK575213
Synonyms: 2- {[5- (3- chlorophenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- chloro- 2- (trifluoromethyl)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2C(F)(F)F)Cl)nnc1c1cccc(c1)Cl

STK575214
Synonyms: 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (2- methoxyphenyl)ethanone
Smiles: COc1ccccc1C(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK575216
Synonyms: 7- benzyl- 6- hydroxy- 3- methyl- 8- {[3- (morpholin- 4- yl)propyl]amino}- 3,7- dihydro- 2H- purin- 2- one
Smiles: Oc1nc(=O)n(c2c1n(Cc1ccccc1)c(n2)NCCCN1CCOCC1)C

STK575217
Synonyms: 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- (2- oxopropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(=O)Cn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK575218
Synonyms: 5- {(2E)- 3- [4- (diethylamino)phenyl]prop- 2- enoyl}- 2,6- dihydroxy- 3- (2- phenylethyl)pyrimidin- 4(3H)- one
Smiles: CCN(c1ccc(cc1)/C=C/C(=O)c1c(O)nc(n(c1=O)CCc1ccccc1)O)CC

STK575219
Synonyms: 1,3- dimethyl- 5- {[2- (4- methylpiperazin- 1- yl)- 4- oxo- 4H- pyrido[1,2- a]pyrimidin- 3- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CN1CCN(CC1)c1nc2ccccn2c(=O)c1C=C1C(=O)N(C)C(=O)N(C1=O)C

STK575220
Synonyms: N- (2,5- dimethylphenyl)- 2- {[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cc(C)ccc2C)nnc1c1cccc(c1)C

STK575221
Synonyms: 9- (3- chlorophenyl)- 6- (furan- 2- yl)- 2- methyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: Clc1cccc(c1)C1C2=C(O)CC(CC2=Nc2n1nc(n2)C)c1ccco1

STK575222
Synonyms: 5- (2- fluorophenyl)- 4- {[(E)- (3- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)/C=N/n1c(=S)[nH]nc1c1ccccc1F

STK575223
Synonyms: (E)- N- {[8- (4- chlorophenyl)- 11- (2- methoxyphenyl)- 10- methyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- phenylmethanimine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C/c1ccccc1)c1ccc(cc1)Cl

STK575224
Synonyms: 2,2- dimethyl- 5- (propan- 2- yl)- N- (pyridin- 2- ylmethyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- amine
Smiles: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1ccccn1)C

STK575225
Synonyms: (1Z)- 1- {[(3- chlorophenyl)sulfonyl]methylidene}- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2c(cc1OC)CCN/C/2=C\S(=O)(=O)c1cccc(c1)Cl

STK575226
Synonyms: 9- (4- hydroxyphenyl)- 6- (4- methoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3n(C2c2ccc(cc2)O)ncn3)C1)O

STK575227
Synonyms: 4- (diethylamino)- 1- ethyl- 3- nitroquinolin- 2(1H)- one
Smiles: CCN(c1c2ccccc2n(c(=O)c1[N+](=O)[O-])CC)CC

STK575229
Synonyms: 2- ({[4- (4- methoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)- 1H- benzimidazole
Smiles: COc1ccc(cc1)n1c(SCc2nc3c([nH]2)cccc3)nnc1COc1ccccc1

STK575230
Synonyms: N- [(2Z)- 3- (4- acetylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenylacetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccc(cc1)C(=O)C)CS(=O)(=O)C2)Cc1ccccc1

STK575232
Synonyms: 2- methoxy- N- [(2E)- 3- (4- methoxybenzyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: COCC(=O)/N=C\1/SC2C(N1Cc1ccc(cc1)OC)CS(=O)(=O)C2

STK575233
Synonyms: 10- (3- methoxyphenyl)- 1,3- dimethyl- 5- phenyl- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: COc1cccc(c1)C1OCCn2c1c1n(C)c(=O)n(c(=O)c1c2c1ccccc1)C

STK575234
Synonyms: 8- (4- chlorophenyl)- 11- (4- methoxyphenyl)- 10- methyl- 2- (pyridin- 4- yl)- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccncc1)c1ccc(cc1)Cl

STK575237
Synonyms: 2- {[3- cyano- 4- (2- fluorophenyl)- 5- hydroxy- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N,N- diphenylacetamide
Smiles: N#CC1=C(SCC(=O)N(c2ccccc2)c2ccccc2)N=C2C(=C(O)CCC2)C1c1ccccc1F

STK575239
Synonyms: 3- (1,3- benzodioxol- 5- ylmethyl)- 2'- hydroxy- 1'- methyl- 8- nitro- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: OC1=NC(=O)C2(C(=O)N1C)Cc1cc(ccc1N1C2CN(CC1)Cc1ccc2c(c1)OCO2)[N+](=O)[O-]

STK575241
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (2,2- dimethylpropanoyl)- 2'- {[4- (prop- 2- en- 1- yloxy)phenyl]carbonyl}- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: C=CCOc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C

STK575243
Synonyms: (3a'S,6a'R)- 3'- (1- hydroxyethyl)- 5'- (3- methoxypropyl)- 5,7- dimethyl- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(C)cc2C

STK575244
Synonyms: 3- {(E)- [(2E)- (4,5- diphenyl- 1,3- thiazol- 2(3H)- ylidene)hydrazinylidene]methyl}- 1H- indole
Smiles: c1ccc(cc1)c1[nH]/c(=N\N=C\c2c[nH]c3c2cccc3)/sc1c1ccccc1

STK575247
Synonyms: (4E)- 1- {5- [(2,4- dichlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- [3- (prop- 2- en- 1- yloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: C=CCOc1cccc(c1)C1N(c2nnc(s2)SCc2ccc(cc2Cl)Cl)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK575252
Synonyms: 7- bromo- 3- (2- phenylethyl)- 2- (thiophen- 2- yl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: Brc1ccc2c(c1)c(=O)c1c(o2)nc(n(c1=O)CCc1ccccc1)c1cccs1

STK575255
Synonyms: 7'- [(Z)- (1- ethyl- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)methyl]- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: CCN1C(=O)N=C(/C(=C/c2ccc3c(c2)CC2(C4N3CCC4)C(=O)N(C)C(=O)N(C2=O)C)/C1=O)O

STK575256
Synonyms: 3- [(E)- (2- benzylhydrazinylidene)methyl]- 2- chloro- 7- methylquinoline
Smiles: Cc1ccc2c(c1)nc(c(c2)/C=N/NCc1ccccc1)Cl

STK575257
Synonyms: 3- [2- (diethylamino)ethyl]- 5- methyl- 3,5- dihydro- 4H- pyrimido[5,4- b]indol- 4- one
Smiles: CCN(CCn1cnc2c(c1=O)n(C)c1c2cccc1)CC

STK575258
Synonyms: 8- (2,3- dimethoxyphenyl)- 9- (5- methyl- 1,2- oxazol- 3- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: COc1c(OC)cccc1C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK575260
Synonyms: N- (2- chlorophenyl)- 1,4- bis(4- chlorophenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Clc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1Cl)c1ccc(cc1)Cl

STK575261
Synonyms: 8- chloro- 2,2- dimethyl- 5- propyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CCCc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3Cl

STK575262
Synonyms: 1- [1- hydroxy- 3,3- dimethyl- 11- (2,3,4- trimethoxyphenyl)- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl]ethanone
Smiles: COc1ccc(c(c1OC)OC)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C)cccc2)(C)C

STK575264
Synonyms: N- [(2Z)- 3- (5- chloro- 2,4- dimethoxyphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- methylpropanamide
Smiles: COc1cc(OC)c(cc1N1/C(=N/C(=O)C(C)C)/SC2C1CS(=O)(=O)C2)Cl

STK575265
Synonyms: 10,10- dimethyl- N- (pyridin- 4- ylmethyl)- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: O=C(c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2)NCc1ccncc1

STK575267
Synonyms: 8- [(3,4- dimethoxyphenyl)sulfonyl]- 7- methyl- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: COc1ccc(cc1OC)S(=O)(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

STK575268
Synonyms: 9- (3- fluorophenyl)- 6,6- dimethyl- 2- (methylsulfanyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CSc1nn2c(n1)N=C1C(=C(O)CC(C1)(C)C)C2c1cccc(c1)F

STK575269
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 5- (3- ethoxyphenyl)- 1- (6- methoxy- 1,3- benzothiazol- 2- yl)pyrrolidine- 2,3- dione
Smiles: CCOc1cccc(c1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)OC

STK575270
Synonyms: (1'S,3R,3'S,7a'S)- 6''- chloro- 1'- [(2,4- dichlorophenyl)carbonyl]- 7''- methyl- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2ccc(c1C)Cl

STK575271
Synonyms: tert- butyl[(1S)- 1- (5- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 1,3,4- oxadiazol- 2- yl)- 2- (1H- indol- 3- yl)ethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)SCC(=O)c1ccc(cc1)Cl)Cc1c[nH]c2c1cccc2

STK575272
Synonyms: 8- [(E)- (1,3- dihydro- 2H- benzimidazol- 2- ylidenehydrazinylidene)methyl]- 2,3- dihydro[1,4]dioxino[2,3- g]quinolin- 7(6H)- one
Smiles: O=c1[nH]c2cc3OCCOc3cc2cc1/C=N/N=c/1\[nH]c2c([nH]1)cccc2

STK575274
Synonyms: N- butyl- N- [(6- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]methanesulfonamide
Smiles: CCCCN(S(=O)(=O)C)Cc1cc2cc(C)ccc2[nH]c1=O

STK575275
Synonyms: N- [(2Z)- 4- (4- chlorophenyl)- 1,3- thiazol- 2(3H)- ylidene]- 2- (4- phenylpiperazin- 1- yl)acetamide
Smiles: Clc1ccc(cc1)c1cs/c(=N\C(=O)CN2CCN(CC2)c2ccccc2)/[nH]1

STK575276
Synonyms: 2- [9- (4- butylphenyl)- 1- methyl- 2,4- dioxo- 1,4,6,7,8,9- hexahydropyrimido[2,1- f]purin- 3(2H)- yl]acetamide
Smiles: CCCCc1ccc(cc1)N1CCCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)N

STK575277
Synonyms: N- [6- chloro- 3- (3,4- dimethoxyphenyl)- 4- oxo- 4H- chromen- 2- yl]furan- 2- carboxamide
Smiles: COc1cc(ccc1OC)c1c(NC(=O)c2ccco2)oc2c(c1=O)cc(cc2)Cl

STK575278
Synonyms: methyl4- [(E)- {2- [(5- {3- [(4- chlorobenzyl)oxy]phenyl}- 1H- pyrazol- 3- yl)carbonyl]hydrazinylidene}methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccc(cc1)Cl

STK575280
Synonyms: 1- {[1- (tert- butoxycarbonyl)- 4- phenylpiperidin- 4- yl]carbonyl}- L- prolyl- D- valine
Smiles: CC([C@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1)C

STK575282
Synonyms: 8- ethoxy- 5- (2- methylpropyl)- 1,2,3,4- tetrahydropyrimido[4',5':4,5]furo[2,3- c]isoquinoline
Smiles: CCOc1ncnc2c1oc1c2c2CCCCc2c(n1)CC(C)C

STK575284
Synonyms: 1- benzyl- 2- phenyl- 1H- imidazo[1,2- a]benzimidazole
Smiles: c1ccc(cc1)Cn1c(cn2c1nc1c2cccc1)c1ccccc1

STK575286
Synonyms: 1- [2- (dimethylamino)ethyl]- 3- (furan- 2- ylmethyl)- 1,5,6,7,8,9- hexahydro- 2H- cyclohepta[4,5]thieno[2,3- d]pyrimidine- 2,4(3H)- dione
Smiles: CN(CCn1c2sc3c(c2c(=O)n(c1=O)Cc1ccco1)CCCCC3)C

STK575288
Synonyms: (3S)- N- {(1R)- 2- [(3- methylphenyl)amino]- 2- oxo- 1- phenylethyl}- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: Cc1cccc(c1)NC(=O)[C@@H](c1ccccc1)NC(=O)[C@H]1NCc2c(C1)cccc2

STK575289
Synonyms: 6,7- dimethoxy- N- (3- methoxypropyl)- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: COCCCNC(=S)N1CCc2c(C1)cc(c(c2)OC)OC

STK575290
Synonyms: 2- {[5- (benzylamino)- 10- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[4,3- c]pyrimidin- 3- yl]sulfanyl}- 1- phenylethanone
Smiles: CC1CCc2c(C1)c1c(s2)nc(n2c1nnc2SCC(=O)c1ccccc1)NCc1ccccc1

STK575292
Synonyms: N- (4- fluorophenyl)- 2- hydroxy- 7- (4- methoxyphenyl)- 5- oxo- 3,4,5,6,7,8- hexahydroquinoline- 4- carboxamide
Smiles: COc1ccc(cc1)C1CC(=O)C2=C(C1)N=C(CC2C(=O)Nc1ccc(cc1)F)O

STK575293
Synonyms: (E)- {1- [2- (diethylammonio)ethyl]- 2- (3,4- dimethoxyphenyl)- 4,5- dioxopyrrolidin- 3- ylidene}(4- nitrophenyl)methanolate
Smiles: CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)[N+](=O)[O-])/[O-])/C1c1ccc(c(c1)OC)OC)CC

STK575294
Synonyms: 5- [3- (benzyloxy)phenyl]- N'- [(E)- (3- bromophenyl)methylidene]- 1H- pyrazole- 3- carbohydrazide
Smiles: Brc1cccc(c1)/C=N/NC(=O)c1n[nH]c(c1)c1cccc(c1)OCc1ccccc1

STK575295
Synonyms: 8- (azepanium- 1- ylmethyl)- 3- (3- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- olate
Smiles: COc1cccc(c1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+]1CCCCCC1)[O-]

STK575296
Synonyms: (2Z)- 7- [(2- methylpiperidinium- 1- yl)methyl]- 2- (4- nitrobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: O=C1/C(=C/c2ccc(cc2)[N+](=O)[O-])/Oc2c1ccc(c2C[NH+]1CCCCC1C)[O-]

STK575298
Synonyms: (3a'S,6a'R)- 7- chloro- 3'- (4- hydroxybenzyl)- 5'- (2- methoxyethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cccc2Cl

STK575299
Synonyms: ethyl1- (6- chloro- 2- hydroxy- 4- phenylquinolin- 3- yl)piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK575300
Synonyms: 4- {[(E)- (2- methylphenyl)methylidene]amino}- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Cc1ccccc1/C=N/n1c(=S)[nH]nc1c1ccccn1

STK575301
Synonyms: N- (3- acetylphenyl)- 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1cccc(c1)C(=O)C)CCn1nnc2c(c1=O)cccc2

STK575302
Synonyms: 9- (3,4- dimethylphenyl)- 7- hydroxy- 1- methyl- 3- (3- methylbenzyl)- 6,7,8,9- tetrahydropyrimido[2,1- f]purine- 2,4(1H,3H)- dione
Smiles: Cc1cccc(c1)Cn1c(=O)c2n3CC(O)CN(c3nc2n(c1=O)C)c1ccc(c(c1)C)C

STK575303
Synonyms: 6'- hydroxy- 2,4- dimethyl- 8- nitro- 3'- (2- phenylethyl)- 1,2,4,4a- tetrahydro- 2'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)CCc1ccccc1)O)[N+](=O)[O-]

STK575304
Synonyms: (3a'S,6a'R)- 5'- [2- (3,4- dimethoxyphenyl)ethyl]- 5- fluoro- 3'- (1H- indol- 3- ylmethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(NC3Cc3c[nH]c4c3cccc4)C(=O)Nc3c2cc(F)cc3)ccc1OC

STK575306
Synonyms: (3S,3'R,3a'R,6a'S)- 5- chloro- 3'- [(4- chlorophenyl)(hydroxy)methyl]- 5'- (2- phenylethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Clc1ccc2c(c1)[C@]1(N[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)[C@@H](c1ccc(cc1)Cl)O)C(=O)N2

STK575307
Synonyms: (4E)- 6- {[4- (3- chlorophenyl)piperazin- 1- yl]methyl}- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylimino)- 4,5- dihydro- 1,3,5- triazin- 2- amine
Smiles: Clc1cccc(c1)N1CCN(CC1)Cc1nc(N)n/c(=N/c2ccc3c(c2)OCCO3)/[nH]1

STK575308
Synonyms: 4- (4- benzylpiperazin- 1- yl)- 2- ethyl[1]benzofuro[3,2- d]pyrimidine
Smiles: CCc1nc(N2CCN(CC2)Cc2ccccc2)c2c(n1)c1ccccc1o2

STK575309
Synonyms: (5Z)- 5- [(5- chlorothiophen- 2- yl)methylidene]- 3- (4- fluorobenzyl)- 2- hydroxy- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: Fc1ccc(cc1)CN1C(=N/C(=C\c2ccc(s2)Cl)/C1=O)O

STK575310
Synonyms: N- [(2Z)- 3- (2- fluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- (thiophen- 2- yl)acetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccccc1F)CS(=O)(=O)C2)Cc1cccs1

STK575312
Synonyms: methylN- [(3- methylphenyl)carbamoyl]- D- leucinate
Smiles: COC(=O)[C@H](NC(=O)Nc1cccc(c1)C)CC(C)C

STK575313
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- difluorophenyl)acetamide
Smiles: O=C(Nc1ccc(cc1F)F)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK575316
Synonyms: (3a'S,6a'R)- 5'- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5- ethyl- 3'- (1H- indol- 3- ylmethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc3c(c1)OCCO3)Cc1c[nH]c3c1cccc3)C(=O)N2

STK575317
Synonyms: 3- (3,4- dimethoxyphenyl)- 12- (pyridin- 3- yl)- 2,3,4,12- tetrahydrobenzimidazo[2,1- b]quinazolin- 1- ol
Smiles: COc1cc(ccc1OC)C1CC(=C2C(=Nc3n(C2c2cccnc2)c2c(n3)cccc2)C1)O

STK575318
Synonyms: 2- {[5- (4- tert- butylphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (3- methoxyphenyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2cccc(c2)OC)nnc1c1ccc(cc1)C(C)(C)C

STK575319
Synonyms: 3- {4- (4- chlorophenyl)- 5- [(naphthalen- 1- ylmethyl)sulfanyl]- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: Clc1ccc(cc1)n1c(SCc2cccc3c2cccc3)nnc1c1cccnc1

STK575320
Synonyms: (5Z)- 3- (4- chlorophenyl)- 6- hydroxy- 5- (1- {[3- (trifluoromethyl)phenyl]amino}ethylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: Clc1ccc(cc1)N1C(=O)N=C(/C(=C(/Nc2cccc(c2)C(F)(F)F)\C)/C1=O)O

STK575321
Synonyms: methyl4- (8- cyclohexylidene- 1,3- dioxo- 1,3,3a,4,7,7a- hexahydro- 2H- 4,7- methanoisoindol- 2- yl)benzoate
Smiles: COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1C(=C3CCCCC3)C2C=C1

STK575322
Synonyms: N- [(2E)- 4,6- dimethylpyrimidin- 2(1H)- ylidene]- 1,5- bis(4- methoxybenzyl)- 1,4,5,6- tetrahydro- 1,3,5- triazin- 2- amine
Smiles: COc1ccc(cc1)CN1CN=C(N(C1)Cc1ccc(cc1)OC)/N=c\1/nc(C)cc([nH]1)C

STK575323
Synonyms: 1- (1- {6- [(2,4- difluorophenyl)amino]pyrimidin- 4- yl}- 5- methyl- 1H- pyrazol- 4- yl)ethanone
Smiles: Fc1ccc(c(c1)F)Nc1ncnc(c1)n1ncc(c1C)C(=O)C

STK575326
Synonyms: 2- hydroxy- N'- {(E)- [1- (propan- 2- yl)- 1H- indol- 3- yl]methylidene}benzohydrazide
Smiles: O=C(c1ccccc1O)N/N=C/c1cn(c2c1cccc2)C(C)C

STK575327
Synonyms: 3- (4- chlorophenyl)- 2- [(2- hydroxyethyl)amino]- 7- methyl- 5,6,7,8- tetrahydropyrido[4',3':4,5]thieno[2,3- d]pyrimidin- 4(3H)- one
Smiles: OCCNc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCN(C3)C

STK575329
Synonyms: 7- (2- chlorobenzyl)- 1,3- dimethyl- 8- [(4- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC1CCN(CC1)Cc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)C

STK575330
Synonyms: 9- (3- ethoxy- 4- hydroxyphenyl)- 2- (ethylsulfanyl)- 6,6- dimethyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCOc1cc(ccc1O)C1C2=C(O)CC(CC2=Nc2n1nc(n2)SCC)(C)C

STK575332
Synonyms: 2- {[5- (3- chlorophenyl)- 4- ethyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (propan- 2- yl)phenyl]acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)C(C)C)nnc1c1cccc(c1)Cl

STK575334
Synonyms: 1,1'- {[4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- yl]imino}dipropan- 2- ol
Smiles: CC(CN(c1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C)CC(O)C)O

STK575336
Synonyms: ethyl2- amino- 6- benzyl- 7- methyl- 5- oxo- 4- (pyridin- 4- yl)- 5,6- dihydro- 4H- pyrano[3,2- c]pyridine- 3- carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccncc1)c(=O)n(c(c2)C)Cc1ccccc1

STK575337
Synonyms: N- (2,5- dimethylphenyl)- 6- (3- ethoxy- 4- hydroxyphenyl)- 2- hydroxy- 4- methyl- 1,6- dihydropyrimidine- 5- carboxamide
Smiles: CCOc1cc(ccc1O)C1NC(=NC(=C1C(=O)Nc1cc(C)ccc1C)C)O

STK575340
Synonyms: (3a'S,6a'R)- 5- fluoro- 5'- (2- phenylethyl)- 3'- (propan- 2- yl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)CCc1ccccc1)C(C)C)C(=O)N2

STK575341
Synonyms: N- (3- methoxypropyl)- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: COCCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK575344
Synonyms: N- [(2Z)- 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1c1ccc3c(c1)OCCO3)CS(=O)(=O)C2

STK575345
Synonyms: (5E)- 5- {[2,5- dimethyl- 1- (2- methyl- 4- nitrophenyl)- 1H- pyrrol- 3- yl]methylidene}- 1- ethyl- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CCN1C(=NC(=O)/C(=C\c2cc(n(c2C)c2ccc(cc2C)[N+](=O)[O-])C)/C1=O)S

STK575346
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- chloro- 4,6- dimethylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1c(C)cc(cc1Cl)C

STK575347
Synonyms: 1- (4- hydroxy- 3- methoxyphenyl)- 2- (6- methyl- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1O)C1N(c2nc3c(s2)cc(cc3)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK575348
Synonyms: 1- [(4- chlorophenyl)sulfonyl]- 5- (furan- 2- yl)- 3- (4- methylphenyl)- 4,5- dihydro- 1H- pyrazole
Smiles: Cc1ccc(cc1)C1=NN(C(C1)c1ccco1)S(=O)(=O)c1ccc(cc1)Cl

STK575349
Synonyms: 3- [(4- bromobenzyl)sulfanyl]- 4- (4- chlorophenyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazole
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCc1ccc(cc1)Br

STK575350
Synonyms: N- {1- [2- (6- methoxy- 1H- indol- 3- yl)ethyl]- 6,6- dimethyl- 2,4- dioxo- 3- (trifluoromethyl)- 2,3,4,5,6,7- hexahydro- 1H- indol- 3- yl}acetamide
Smiles: COc1ccc2c(c1)[nH]cc2CCN1C2=C(C(C1=O)(NC(=O)C)C(F)(F)F)C(=O)CC(C2)(C)C

STK575351
Synonyms: 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 7- (2- methoxyethyl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCn1c(CN2CCN(CC2)c2ccc(cc2)F)nc2c1c(=O)n(c(=O)n2C)C

STK575353
Synonyms: N- (furan- 2- ylmethyl)- 6,7- dimethoxy- 3,4- dihydroisoquinoline- 2(1H)- carbothioamide
Smiles: COc1cc2CN(CCc2cc1OC)C(=S)NCc1ccco1

STK575354
Synonyms: 2- [(2- chloro- 6- oxo- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- yl)oxy]- N- (pyridin- 4- ylmethyl)propanamide
Smiles: O=C(C(Oc1cc2oc(=O)c3c(c2cc1Cl)CCCC3)C)NCc1ccncc1

STK575357
Synonyms: biphenyl- 2- yl(7- methylidene- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)methanone
Smiles: C=C1c2cc3OCCCOc3cc2CCN1C(=O)c1ccccc1c1ccccc1

STK575359
Synonyms: {(5S)- 5- [(4- acetylphenyl)carbamoyl]- 3- [4- (cyanomethoxy)- 3- methoxyphenyl]- 4,5- dihydro- 1,2- oxazol- 5- yl}aceticacid
Smiles: N#CCOc1ccc(cc1OC)C1=NO[C@@](C1)(CC(=O)O)C(=O)Nc1ccc(cc1)C(=O)C

STK575361
Synonyms: (4Z)- 4- (hydroxyimino)- 3,6,6- trimethyl- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O/N=C\1/CC(C)(C)Cc2c1c(C)c(o2)C(=O)N

STK575362
Synonyms: N- [3,5- bis(trifluoromethyl)phenyl]- 2- {[5- (2- fluorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nnc(n1c1ccccc1)c1ccccc1F

STK575363
Synonyms: 7- methyl- 3- [(Z)- (4- oxo- 3- pentyl- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: CCCCCN1C(=S)S/C(=C\c2c(nc3n(c2=O)cc(cc3)C)N2CCN(CC2)c2ccccc2)/C1=O

STK575366
Synonyms: N- (furan- 2- ylmethyl)- 2,2,5- trimethyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- amine
Smiles: Cc1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3NCc1ccco1

STK575371
Synonyms: S- benzyl- N- {[trans- 4- ({[(6- chloro- 7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetyl]amino}methyl)cyclohexyl]carbonyl}- D- cysteine
Smiles: COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)NC[C@@H]1CC[C@H](CC1)C(=O)N[C@@H](C(=O)O)CSCc1ccccc1

STK575372
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2- chlorophenyl)carbonyl]- 3'- [(2,4- dichlorophenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1Cl)C(=O)Nc1c2cccc1)cccc3

STK575373
Synonyms: methylN- {(1Z)- 1- [4- hydroxy- 1- (2- methylphenyl)- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]ethyl}tryptophanate
Smiles: COC(=O)C(Cc1c[nH]c2c1cccc2)N/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1C)O)/C

STK575376
Synonyms: (2E)- N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 3- [3- methoxy- 4- (pentyloxy)phenyl]prop- 2- enamide
Smiles: CCCCCOc1ccc(cc1OC)/C=C/C(=O)/N=c\1/sc2c([nH]1)cccc2

STK575377
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2,4- dichlorophenyl)carbonyl]- 2'- (phenylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: Clc1ccc(c(c1)Cl)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccccc1)C(=O)Nc1c2cccc1)cccc3

STK575378
Synonyms: 3- benzyl- 6- chloro- 4- methyl- 2- oxo- 2H- chromen- 7- ylN- (tert- butoxycarbonyl)norvalinate
Smiles: CCCC(C(=O)Oc1cc2oc(=O)c(c(c2cc1Cl)C)Cc1ccccc1)NC(=O)OC(C)(C)C

STK575380
Synonyms: N'- [(E)- (5- methoxy- 1H- indol- 3- yl)methylidene]pyridine- 4- carbohydrazide
Smiles: COc1ccc2c(c1)c(/C=N/NC(=O)c1ccncc1)c[nH]2

STK575382
Synonyms: (3a'S,6a'R)- 5'- butyl- 5- chloro- 3'- [2- (methylsulfanyl)ethyl]- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CSCCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCCC)C(=O)Nc1c2cc(Cl)cc1

STK575383
Synonyms: 7- (3,4- dichlorobenzyl)- 6- hydroxy- 3- methyl- 8- (4- methylpiperazin- 1- yl)- 3,7- dihydro- 2H- purin- 2- one
Smiles: CN1CCN(CC1)c1nc2c(n1Cc1ccc(c(c1)Cl)Cl)c(O)nc(=O)n2C

STK575384
Synonyms: 9- (2,3- dimethoxyphenyl)- 6- phenyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1cccc(c1OC)C1C2=C(O)CC(CC2=Nc2n1ncn2)c1ccccc1

STK575385
Synonyms: 2- {[2,2- dimethyl- 5- (2- methylpropyl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- yl](methyl)amino}ethanol
Smiles: OCCN(c1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)CC(C)C)C

STK575386
Synonyms: N- [3- (3- chlorophenyl)- 4- oxo- 4H- thiochromen- 2- yl]- 2- phenylacetamide
Smiles: O=C(Nc1sc2ccccc2c(=O)c1c1cccc(c1)Cl)Cc1ccccc1

STK575388
Synonyms: ethyl{[2- (4- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)OC

STK575390
Synonyms: 2- (6- chloro- 1,3- benzothiazol- 2- yl)- 1- (4- ethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK575392
Synonyms: 5- [(2,6- dichlorobenzyl)amino]- 2- (morpholin- 4- ium- 4- yl)benzoate
Smiles: [O-]C(=O)c1cc(ccc1[NH+]1CCOCC1)NCc1c(Cl)cccc1Cl

STK575393
Synonyms: (5E)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 1- (2- fluorophenyl)- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN(CCCN/C=C/1\C(=O)N=C(N(C1=O)c1ccccc1F)S)C

STK575394
Synonyms: N'- [6- ethyl- 6- methyl- 2- (methylsulfanyl)- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]propanehydrazide
Smiles: CCC(=O)NNc1nc(SC)nc2c1c1CC(C)(CC)OCc1s2

STK575395
Synonyms: (3a'R,8b'S)- 5- chloro- 2'- [2- (3,4- dimethoxyphenyl)ethyl]- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: COc1cc(CCN2C(=O)[C@H]3[C@@H](C2=O)C2(N4C3CCC4)C(=O)Nc3c2cc(Cl)cc3)ccc1OC

STK575396
Synonyms: 3- (3- chlorophenyl)- 5- [(3- fluorobenzyl)sulfanyl]- 4- phenyl- 4H- 1,2,4- triazole
Smiles: Fc1cccc(c1)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl

STK575398
Synonyms: 7- (2- fluorobenzyl)- 8- {[4- (4- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1ccccc1F)c(=O)n(c(=O)n2C)C

STK575399
Synonyms: 7- chloro- 2- (2- phenylethyl)- 1- (3,4,5- trimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(cc(c1OC)OC)C1N(CCc2ccccc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK575400
Synonyms: 2,6- dichloro- N- [3- (methylsulfanyl)- 1- ([1,2,4]triazolo[4,3- a]pyridin- 3- yl)propyl]pyridine- 4- carboxamide
Smiles: CSCCC(c1nnc2n1cccc2)NC(=O)c1cc(Cl)nc(c1)Cl

STK575401
Synonyms: 2- [(8- chloro- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yl)oxy]- N- [3- (dimethylamino)propyl]propanamide
Smiles: CN(CCCNC(=O)C(Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3)C)C

STK575402
Synonyms: N'- [(E)- {1- [2- (3,4- dimethoxyphenyl)ethyl]- 2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene}methyl]pyridine- 4- carbohydrazide
Smiles: COc1cc(CCN2C(=NC(=O)/C(=C\NNC(=O)c3ccncc3)/C2=O)O)ccc1OC

STK575404
Synonyms: N- [(2Z)- 3- (1,3- benzodioxol- 5- yl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]butanamide
Smiles: CCCC(=O)/N=C/1\SC2C(N1c1ccc3c(c1)OCO3)CS(=O)(=O)C2

STK575405
Synonyms: N- (2- methylpropyl)- 4- nitro- N- [(2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]benzenesulfonamide
Smiles: CC(CN(S(=O)(=O)c1ccc(cc1)[N+](=O)[O-])Cc1cc2ccccc2[nH]c1=O)C

STK575406
Synonyms: (5E)- 5- [4- (azepan- 1- yl)benzylidene]- 3- butyl- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CCCCN1C(=O)N=C(/C(=C\c2ccc(cc2)N2CCCCCC2)/C1=O)O

STK575407
Synonyms: 2- {[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK575410
Synonyms: 7- (4- chlorobenzyl)- 8- [(2E)- 2- (4- fluorobenzylidene)hydrazinyl]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Fc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccc(cc1)Cl)c(O)nc(=O)n2C

STK575411
Synonyms: N- {4- [(3E)- 3- [hydroxy(phenyl)methylidene]- 2- (4- nitrophenyl)- 4,5- dioxopyrrolidin- 1- yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(c2ccc(cc2)[N+](=O)[O-])/C(=C(/c2ccccc2)\O)/C(=O)C1=O

STK575412
Synonyms: (7- methylidene- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinolin- 8(7H)- yl)[2- (trifluoromethyl)phenyl]methanone
Smiles: C=C1c2cc3OCCCOc3cc2CCN1C(=O)c1ccccc1C(F)(F)F

STK575415
Synonyms: N- [1- methyl- 3- (4- methylphenyl)- 4- oxo- 1,4- dihydroquinolin- 2- yl]propanamide
Smiles: CCC(=O)Nc1c(c2ccc(cc2)C)c(=O)c2c(n1C)cccc2

STK575416
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- fluorophenyl)acetamide
Smiles: O=C(Nc1ccccc1F)CSc1nnc(n1Cc1ccco1)COc1ccc(cc1)Cl

STK575419
Synonyms: (E)- [4,5- dioxo- 1- (pyridinium- 4- ylmethyl)- 2- (pyridin- 4- yl)pyrrolidin- 3- ylidene]{4- [(3- methylbenzyl)oxy]phenyl}methanolate
Smiles: Cc1cccc(c1)COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccncc1)Cc1cc[nH+]cc1)/[O-]

STK575420
Synonyms: 5- (3- methoxyphenyl)- 4- {[(E)- (3- phenoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)Oc1ccccc1

STK575421
Synonyms: 3- hydroxy- 2- {(2E)- 2- [1- (4- hydroxyphenyl)ethylidene]hydrazinyl}quinazolin- 4(3H)- one
Smiles: Oc1ccc(cc1)/C(=N/Nc1nc2ccccc2c(=O)n1O)/C

STK575423
Synonyms: 6- butyl- 2,5- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCCCc1c(C)nc2n(c1O)nc(n2)C

STK575425
Synonyms: 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- [3- (propan- 2- yloxy)propyl]hexanamide
Smiles: CC(OCCCNC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK575428
Synonyms: 4- {[(E)- (2,3- dimethoxyphenyl)methylidene]amino}- 5- [4- (dimethylamino)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1c(cccc1OC)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)N(C)C

STK575429
Synonyms: 3- (3- chlorophenyl)- 5- [(3- methylbenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)n1c(SCc2cccc(c2)C)nnc1c1cccc(c1)Cl

STK575430
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,5- dichlorophenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)cc(c2)Cl)nnc1c1cccc(c1)Cl

STK575431
Synonyms: N- (2,4- dichlorophenyl)- 4- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCCn1cnc2c(c1=O)cccc2

STK575433
Synonyms: N- (4- chloro- 2- methylphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)Cl)nnc1Cc1cccs1

STK575434
Synonyms: 2- (6- chloro- 1,3- benzothiazol- 2- yl)- 1- (2,4- dimethoxyphenyl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1ccc(c(c1)OC)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)c2c1c(=O)c1c(o2)cccc1

STK575435
Synonyms: methylN- ({4- [(5- methyl- 1,2- oxazol- 3- yl)sulfamoyl]phenyl}carbamoyl)- L- phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C

STK575438
Synonyms: (3aR,6aS)- 3- (2,5- dimethoxyphenyl)- 5- (naphthalen- 2- yl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: COc1ccc(cc1C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc2c(c1)cccc2)OC

STK575439
Synonyms: 6- (2- chlorophenyl)- 2- methyl- 7- (pyridin- 3- yl)- 7,12- dihydro- 6H- chromeno[4,3- d][1,2,4]triazolo[1,5- a]pyrimidine
Smiles: Cc1ccc2c(c1)C1=C(C(O2)c2ccccc2Cl)C(n2c(N1)ncn2)c1cccnc1

STK575440
Synonyms: ethyl4- (dimethylsulfamoyl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)S(=O)(=O)N(C)C

STK575441
Synonyms: 7- (2,6- dichlorobenzyl)- 8- [(4- ethylpiperazin- 1- yl)methyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1Cc1c(Cl)cccc1Cl)c(=O)n(c(=O)n2C)C

STK575443
Synonyms: 4- {[(E)- (3- methylthiophen- 2- yl)methylidene]amino}- 5- [3- (propan- 2- yloxy)phenyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1sccc1C)C

STK575444
Synonyms: N- [(2Z)- 3- (2,4- difluorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenylacetamide
Smiles: O=C(/N=C/1\SC2C(N1c1ccc(cc1F)F)CS(=O)(=O)C2)Cc1ccccc1

STK575446
Synonyms: (2E)- N- [7- (4- chlorophenyl)- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]- 3- (3- nitrophenyl)prop- 2- enamide
Smiles: O=C(Nc1[nH]c2=NC(=CC(n2n1)c1ccc(cc1)Cl)c1ccccc1)/C=C/c1cccc(c1)[N+](=O)[O-]

STK575447
Synonyms: 4- [(2E)- 2- (2,5- dimethoxybenzylidene)hydrazinyl]- 5- (4- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1N/N=C/c1cc(OC)ccc1OC

STK575448
Synonyms: 3- (2- hydroxyphenyl)- 5- (4- methoxyphenyl)- 4,6- dioxooctahydropyrrolo[3,4- c]pyrrole- 1- carboxylicacid
Smiles: COc1ccc(cc1)N1C(=O)C2C(C1=O)C(NC2c1ccccc1O)C(=O)O

STK575449
Synonyms: 8- (4- ethoxyphenyl)- 1- methyl- 3- [2- (piperidin- 1- yl)ethyl]- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1

STK575450
Synonyms: 4- {[(E)- (3- bromophenyl)methylidene]amino}- 5- (3- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1)Br

STK575451
Synonyms: 3- (4- chlorophenyl)- 8- {[cyclohexyl(ethyl)ammonio]methyl}- 4- oxo- 2- (trifluoromethyl)- 4H- chromen- 7- olate
Smiles: CC[NH+](C1CCCCC1)Cc1c([O-])ccc2c1oc(c(c2=O)c1ccc(cc1)Cl)C(F)(F)F

STK575452
Synonyms: 2- {5- [(4- methoxybenzyl)sulfanyl]- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl}pyrazine
Smiles: COc1ccc(cc1)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK575453
Synonyms: (6E)- 4- (1- benzofuran- 2- yl)- 6- [(3- chloro- 2- methylphenyl)imino]- 1,6- dihydro- 1,3,5- triazin- 2- amine
Smiles: Nc1[nH]/c(=N\c2cccc(c2C)Cl)/nc(n1)c1cc2c(o1)cccc2

STK575454
Synonyms: 3- {2- amino- 3- [(4- chlorophenyl)sulfonyl]- 1H- pyrrolo[2,3- b]quinoxalin- 1- yl}propan- 1- ol
Smiles: OCCCn1c2nc3ccccc3nc2c(c1N)S(=O)(=O)c1ccc(cc1)Cl

STK575455
Synonyms: 2- amino- 1- (3- chloro- 4- fluorophenyl)- N- (3- methylbutyl)- 1H- pyrrolo[2,3- b]quinoxaline- 3- carboxamide
Smiles: CC(CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(c(c1)Cl)F)C

STK575457
Synonyms: methyl4- (7- fluoro- 2- methyl- 3,9- dioxo- 1,2,3,9- tetrahydrochromeno[2,3- c]pyrrol- 1- yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1N(C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK575459
Synonyms: methyl[8- (4- ethoxyphenyl)- 1- methyl- 2,4- dioxo- 1,2,4,6,7,8- hexahydro- 3H- imidazo[2,1- f]purin- 3- yl]acetate
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)OC

STK575460
Synonyms: 6- (2- aminophenyl)- 1,3- dimethyl- 5- (3- methylphenyl)- 1H- pyrrolo[3,4- d]pyrimidine- 2,4(3H,6H)- dione
Smiles: Cc1cccc(c1)c1n(cc2c1c(=O)n(c(=O)n2C)C)c1ccccc1N

STK575461
Synonyms: methylN- (butan- 2- ylcarbamoyl)- L- leucinate
Smiles: CCC(NC(=O)N[C@H](C(=O)OC)CC(C)C)C

STK575462
Synonyms: (5Z)- 5- {[1- (4- chlorophenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 6- hydroxy- 3- (2- phenylethyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: Clc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=NC(=O)N(C1=O)CCc1ccccc1)O

STK575463
Synonyms: (5E)- 3- cyclohexyl- 5- [1- (2,3- dihydro- 1H- inden- 5- ylamino)ethylidene]- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C(\Nc2ccc3c(c2)CCC3)/C)/C(=O)N1C1CCCCC1

STK575464
Synonyms: 2- (5- methoxy- 4,7- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- (tetrahydrofuran- 2- ylmethyl)acetamide
Smiles: COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)NCC1CCCO1

STK575465
Synonyms: 2- {(E)- [1- (butan- 2- yl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}- N- phenylhydrazinecarbothioamide
Smiles: CCC(N1C(=NC(=O)/C(=C\NNC(=S)Nc2ccccc2)/C1=O)S)C

STK575468
Synonyms: 7- (4- fluorobenzyl)- 1,3- dimethyl- 8- [(4- methylpiperazin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CN1CCN(CC1)Cc1nc2c(n1Cc1ccc(cc1)F)c(=O)n(c(=O)n2C)C

STK575473
Synonyms: 1- {4- [(2- chlorobenzyl)oxy]phenyl}- 6,7- dimethyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1onc(c1)N1C(=O)c2c(C1c1ccc(cc1)OCc1ccccc1Cl)c(=O)c1c(o2)cc(c(c1)C)C

STK575474
Synonyms: 2- (6- methylpyridin- 2- yl)- 1- (pyridin- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1cccc(n1)N1C(=O)c2c(C1c1cccnc1)c(=O)c1c(o2)cccc1

STK575475
Synonyms: 4- bromo- N'- [(E)- (2- chloro- 8- methylquinolin- 3- yl)methylidene]benzohydrazide
Smiles: Brc1ccc(cc1)C(=O)N/N=C/c1cc2cccc(c2nc1Cl)C

STK575476
Synonyms: (3a'S,6a'R)- 5- bromo- 5'- (butan- 2- yl)- 3'- (1- hydroxyethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(Br)cc2)C

STK575478
Synonyms: 2- (4- bromo- 3- nitrophenyl)- 4- imino- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: COc1cc2CCn3c(c2cc1OC)cc(c(c3=N)C#N)c1ccc(c(c1)[N+](=O)[O-])Br

STK575480
Synonyms: 2'- hydroxy- 1'- (3- methylphenyl)- 3- nitro- 6a,7,8,9,10,11- hexahydro- 4'H,5H- spiro[azepino[1,2- a]quinoline- 6,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: Cc1cccc(c1)N1C(=NC(=O)C2(C1=O)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-])O

STK575483
Synonyms: 4- chloro- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- (4- methoxyphenyl)benzenesulfonamide
Smiles: COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)Cl)Cc1cc2cc(OC)ccc2[nH]c1=O

STK575485
Synonyms: 3- (2- chloro- 6- fluorobenzyl)- 8- (furan- 2- ylmethyl)- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Fc1cccc(c1Cn1c(=O)c2c(n(c1=O)C)nc1n2c(C)c(n1Cc1ccco1)C)Cl

STK575487
Synonyms: 2- {[3- (4- bromophenyl)- 4- oxo- 3,4- dihydroquinazolin- 2- yl]sulfanyl}- N- [4- (butan- 2- yl)phenyl]acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Br)C

STK575488
Synonyms: 5- (4- fluorophenyl)- 4- {[(E)- (4- methoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F

STK575489
Synonyms: (2Z)- 2- (1,3- benzodioxol- 5- ylmethylidene)- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/Oc2c1ccc(c2C[NH+]1CCOCC1)[O-]

STK575490
Synonyms: 10- (4- hydroxyphenyl)- 1,3,7,7- tetramethyl- 5- (4- methylphenyl)- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: Cc1ccc(cc1)c1c2c(c3n1C(C)(C)COC3c1ccc(cc1)O)n(C)c(=O)n(c2=O)C

STK575492
Synonyms: 13- [4- (dimethylamino)phenyl]- 9,10- dimethoxy- 3,3- dimethyl- 2,3,4,6,7,13- hexahydro- 1H- isoquino[2,1- a]quinolin- 1- one
Smiles: COc1cc2c(cc1OC)CCN1C2=CC(c2ccc(cc2)N(C)C)C2=C1CC(CC2=O)(C)C

STK575494
Synonyms: 3- (2- fluorophenyl)- 2',6'- dihydroxy- 8- nitro- 2,3,4,4a- tetrahydro- 1H,4'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidin]- 4'- one
Smiles: OC1=NC(=O)C2(C(=N1)O)Cc1cc(ccc1N1C2CN(CC1)c1ccccc1F)[N+](=O)[O-]

STK575496
Synonyms: 3- (4- chlorophenyl)- 7- phenyl- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: Clc1ccc(cc1)C1=NOC2(C1)CC(=O)N(C2=O)c1ccccc1

STK575497
Synonyms: 4- [(2E)- 2- {[5- (3- chlorophenyl)furan- 2- yl]methylidene}hydrazinyl]benzoicacid
Smiles: Clc1cccc(c1)c1ccc(o1)/C=N/Nc1ccc(cc1)C(=O)O

STK575499
Synonyms: 8- chloro- 2,2- dimethyl- 5- (propan- 2- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: CC(c1nc2oc3c(c2c2c1COC(C2)(C)C)ncnc3Cl)C

STK575500
Synonyms: N- (2- chlorophenyl)- 1- (4- ethoxyphenyl)- 4- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1Cl)cc3c1ccc(cc1)C

STK575502
Synonyms: 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- N- (3- methylphenyl)acetamide
Smiles: COc1cc2CN(CCc2cc1OC)CC(=O)Nc1cccc(c1)C

STK575506
Synonyms: 3'- tert- butyl- 6'- hydroxy- 2,4- dimethyl- 1,2,4,4a- tetrahydro- 2'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CC1OC(C)C2N(C1)c1ccccc1CC12C(=NC(=O)N(C1=O)C(C)(C)C)O

STK575507
Synonyms: N- benzyl- 2- {[6- cyano- 8,8- dimethyl- 5- (phenylamino)- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridin- 3- yl]sulfanyl}acetamide
Smiles: N#Cc1c2CC(C)(C)OCc2c2n(c1Nc1ccccc1)c(SCC(=O)NCc1ccccc1)nn2

STK575508
Synonyms: 4- {[(E)- (3- bromo- 4- methoxyphenyl)methylidene]amino}- 5- (3,4,5- trimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)Br)OC

STK575509
Synonyms: (5Z)- 2- (4- bromophenyl)- 5- (4- methoxybenzylidene)- 3- (1,3- thiazol- 2- yl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: COc1ccc(cc1)/C=C/1\N=C(N(C1=O)c1nccs1)c1ccc(cc1)Br

STK575510
Synonyms: 3- (3,5- dimethylphenoxy)- 7- [(4- fluorobenzyl)oxy]- 6- hexyl- 2- (trifluoromethyl)- 4H- chromen- 4- one
Smiles: CCCCCCc1cc2c(cc1OCc1ccc(cc1)F)oc(c(c2=O)Oc1cc(C)cc(c1)C)C(F)(F)F

STK575511
Synonyms: (5,7- dimethyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)[4- (2- methoxyphenyl)piperazin- 1- yl]methanone
Smiles: COc1ccccc1N1CCN(CC1)C(=O)c1nn2c(n1)nc(cc2C)C

STK575512
Synonyms: N- [(3Z)- 1- butyl- 8- methyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 4- nitrobenzenesulfonamide
Smiles: CCCCn1[nH]/c(=N\S(=O)(=O)c2ccc(cc2)[N+](=O)[O-])/c2c1nc1c(C)cccc1c2

STK575513
Synonyms: 2- (3- bromophenyl)- 5,6,7,8- tetrahydroquinoxaline1,4- dioxide
Smiles: Brc1cccc(c1)c1c[n+]([O-])c2c([n+]1[O-])CCCC2

STK575514
Synonyms: 8- (4- ethylpiperazin- 1- yl)- 6- hydroxy- 7- [2- hydroxy- 3- (propan- 2- yloxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: CCN1CCN(CC1)c1nc2c(n1CC(COC(C)C)O)c(O)nc(=O)n2C

STK575515
Synonyms: (4Z)- 4- (3,5- dibromo- 4- ethoxybenzylidene)- 2- (naphthalen- 2- yl)- 1,3- oxazol- 5(4H)- one
Smiles: CCOc1c(Br)cc(cc1Br)/C=C/1\N=C(OC1=O)c1ccc2c(c1)cccc2

STK575516
Synonyms: (2E)- N- [(2E)- 1,3- benzothiazol- 2(3H)- ylidene]- 2- cyano- 3- phenylprop- 2- enamide
Smiles: N#C/C(=C\c1ccccc1)/C(=O)/N=c\1/sc2c([nH]1)cccc2

STK575517
Synonyms: (4E)- 4- [hydroxy(4- methylphenyl)methylidene]- 1- (5- methyl- 1,2- oxazol- 3- yl)- 5- [4- (pentyloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: CCCCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1noc(c1)C

STK575518
Synonyms: 3- [(4- {[4- (4- fluorophenyl)piperazin- 1- yl]carbonyl}cyclohexyl)methyl]- 1,2,3- benzotriazin- 4(3H)- one
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)C1CCC(CC1)Cn1nnc2c(c1=O)cccc2

STK575519
Synonyms: tert- butyl(3S)- 3- ({2- [(4- methylphenyl)amino]- 2- oxoethyl}carbamoyl)- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: O=C(Nc1ccc(cc1)C)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK575520
Synonyms: 2'- (1,3- benzothiazol- 2- ylamino)- 5'- hydroxy- 7',7'- dimethyl- 7',8'- dihydro- 6'H- spiro[indole- 3,4'- quinazolin]- 2(1H)- one
Smiles: OC1=C2C(=NC(=NC32C(=O)Nc2c3cccc2)Nc2nc3c(s2)cccc3)CC(C1)(C)C

STK575523
Synonyms: 3- [(3a'S,6a'R)- 5'- (3- methoxypropyl)- 5- methyl- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]propanamide
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cc(C)cc2

STK575525
Synonyms: tert- butyl(3S)- 3- {[2- (2,3- dihydro- 1,4- benzodioxin- 6- ylamino)- 2- oxoethyl]carbamoyl}- 3,4- dihydroisoquinoline- 2(1H)- carboxylate
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C

STK575528
Synonyms: 2- (benzylsulfanyl)- 9- (pyridin- 3- yl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2cccnc2)nc(n3)SCc2ccccc2)CCC1

STK575529
Synonyms: N- (4- chlorophenyl)- 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK575530
Synonyms: N- butyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CCCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CCCC2

STK575533
Synonyms: 8- [(3,4- dimethylphenyl)sulfonyl]- 7- methyl- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: Cc1cc(ccc1C)S(=O)(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

STK575535
Synonyms: 2- methoxy- 4- {(E)- [(3- phenyl- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl)imino]methyl}phenylacetate
Smiles: COc1cc(ccc1OC(=O)C)/C=N/n1c(=S)[nH]nc1c1ccccc1

STK575536
Synonyms: methyl4- {(E)- [(4- oxo- 3- phenyl- 3,4- dihydro- 11H- pyrimido[5',4':4,5]pyrrolo[2,3- b]quinoxalin- 11- yl)imino]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=N/n1c2nc3ccccc3nc2c2c1ncn(c2=O)c1ccccc1

STK575537
Synonyms: 2- (4- bromophenyl)- 4- imino- 9,10- dimethoxy- 6,7- dihydro- 4H- pyrido[2,1- a]isoquinoline- 3- carbonitrile
Smiles: N#Cc1c(cc2n(c1=N)CCc1c2cc(OC)c(c1)OC)c1ccc(cc1)Br

STK575541
Synonyms: 3- methyl- 5- (methylcarbamoyl)- 8- nitro- 2,3,4,4a,5,6- hexahydro- 1H- pyrazino[1,2- a]quinoline- 5- carboxylicacid
Smiles: CNC(=O)C1(Cc2cc(ccc2N2C1CN(C)CC2)[N+](=O)[O-])C(=O)O

STK575542
Synonyms: 7- (4- fluorobenzyl)- 8- [(furan- 2- ylmethyl)amino]- 6- hydroxy- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: Fc1ccc(cc1)Cn1c(NCc2ccco2)nc2c1c(O)nc(=O)n2C

STK575543
Synonyms: 1- (4- ethoxy- 3- methoxyphenyl)- 2- (6- ethyl- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1OC)C1N(c2nc3c(s2)cc(cc3)CC)C(=O)c2c1c(=O)c1c(o2)cccc1

STK575544
Synonyms: 4- ({S- benzyl- N- [(2,5- dimethyl- 7- oxo- 3- phenyl- 7H- furo[3,2- g]chromen- 6- yl)acetyl]- D- cysteinyl}amino)butanoicacid
Smiles: OC(=O)CCCNC(=O)[C@H](NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)oc(c1c1ccccc1)C)CSCc1ccccc1

STK575546
Synonyms: (3S)- N- [(2S)- 1- (cyclopentylamino)- 4- methyl- 1- oxopentan- 2- yl]- 1,2,3,4- tetrahydroisoquinoline- 3- carboxamide
Smiles: CC(C[C@@H](C(=O)NC1CCCC1)NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK575547
Synonyms: methylN- [(2- methylphenyl)carbamoyl]- D- phenylalaninate
Smiles: COC(=O)[C@H](NC(=O)Nc1ccccc1C)Cc1ccccc1

STK575548
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- sulfamoylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)S(=O)(=O)N)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK575549
Synonyms: (E)- N- {[8- (4- chlorophenyl)- 11- (furan- 2- yl)- 10- methyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (3,4- dimethoxyphenyl)methanimine
Smiles: COc1cc(/C=N/OCc2nn3c(n2)c2c(nc3)Oc3c(C2c2ccco2)c(C)nn3c2ccc(cc2)Cl)ccc1OC

STK575550
Synonyms: 2- ({[(5E)- 5- (furan- 2- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]acetyl}amino)- 5- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(cc1C(=O)O)O)CN1C(=S)S/C(=C/c2ccco2)/C1=O

STK575552
Synonyms: 1- (4- ethoxy- 3- methoxyphenyl)- 7- fluoro- 2- (pyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1OC)C1N(c2ccccn2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK575555
Synonyms: 2- ethyl- 3- phenyl- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: CCc1nc2oc3ccccc3c(=O)c2c(=O)n1c1ccccc1

STK575557
Synonyms: 6- hydroxy- 8- [(2- hydroxyethyl)amino]- 7- [2- hydroxy- 3- (4- methylphenoxy)propyl]- 3- methyl- 3,7- dihydro- 2H- purin- 2- one
Smiles: OCCNc1nc2c(n1CC(COc1ccc(cc1)C)O)c(O)nc(=O)n2C

STK575559
Synonyms: 9- methyl- 1'- pentyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[benzo[g]pyrido[1,2- a][1,8]naphthyridine- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: CCCCCN1C(=O)NC(=O)C2(C1=O)Cc1cc3cc(C)ccc3nc1N1C2CCCC1

STK575560
Synonyms: 7- (2- methoxyethyl)- 1,3- dimethyl- 8- [(3- methylpiperidin- 1- yl)methyl]- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: COCCn1c(CN2CCCC(C2)C)nc2c1c(=O)n(c(=O)n2C)C

STK575565
Synonyms: N- (3- methoxyphenyl)- 4- (4- methylphenyl)- 1- [4- (propan- 2- yl)phenyl]- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)C(C)C)CCCC3)c1ccc(cc1)C

STK575568
Synonyms: N- [4- chloro- 3- (trifluoromethyl)phenyl]- 2- {[5- (2- methoxyphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)C(F)(F)F)Cl)nnc1c1ccccc1OC

STK575569
Synonyms: (2Z)- 7- {[bis(2- methoxyethyl)ammonio]methyl}- 3- oxo- 2- [4- (propan- 2- yl)benzylidene]- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)C(C)C)/C2=O)CCOC

STK575570
Synonyms: 1- {[1- (tert- butoxycarbonyl)- 4- phenylpiperidin- 4- yl]carbonyl}- L- prolyl- L- methionine
Smiles: CSCC[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccccc1

STK575572
Synonyms: (4E)- 2- (3,5- dimethylphenyl)- 4- ({[3- (morpholin- 4- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: Cc1cc(C)cc(c1)N1C(=O)/C(=C/NCCCN2CCOCC2)/c2c(C1=O)cccc2

STK575573
Synonyms: N- (3,5- dimethoxyphenyl)- 2- {[4- ethyl- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1cc(NC(=O)CSc2nnc(n2CC)Cc2cccs2)cc(c1)OC

STK575574
Synonyms: 5- (3- methylphenyl)- 4- {[(E)- (2,4,5- trimethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1cc(OC)c(cc1/C=N/n1c(=S)[nH]nc1c1cccc(c1)C)OC

STK575575
Synonyms: 8- (4- ethoxyphenyl)- 3- ethyl- 1- methyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCOc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC

STK575577
Synonyms: (E)- {2- (3- ethoxy- 4- hydroxyphenyl)- 1- [3- (morpholin- 4- ium- 4- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}(4- fluorophenyl)methanolate
Smiles: CCOc1cc(ccc1O)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)F)/[O-]

STK575578
Synonyms: (2Z)- N- (3- chloro- 2- methylphenyl)- 2- (7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 5(6H)- ylidene)ethanethioamide
Smiles: S=C(Nc1cccc(c1C)Cl)/C=C/1\NCCc2c1cc1OCOc1c2

STK575579
Synonyms: 9- bromo- 2- (3,4- dimethoxyphenyl)- 5- (3- fluorophenyl)- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: COc1ccc(cc1OC)C1=NN2C(C1)c1cc(Br)ccc1OC2c1cccc(c1)F

STK575581
Synonyms: (5E)- 5- ({[3- (dimethylamino)propyl]amino}methylidene)- 6- hydroxy- 3- (3- methoxyphenyl)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cccc(c1)N1C(=O)N=C(/C(=C\NCCCN(C)C)/C1=O)O

STK575583
Synonyms: N- (2- tert- butylphenyl)- 2- {[5- (2- methoxyphenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccccc1c1nnc(n1c1ccccc1)SCC(=O)Nc1ccccc1C(C)(C)C

STK575584
Synonyms: 8- [(4- fluorophenyl)sulfonyl]- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: Fc1ccc(cc1)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK575585
Synonyms: N- (3- fluoro- 4- methylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccc(cc1)C)c1ccccn1

STK575586
Synonyms: N- cycloheptyl- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: O=C(NC1CCCCCC1)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK575587
Synonyms: N- [(2Z)- 3- (2,3- dichlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1c1cccc(c1Cl)Cl)CS(=O)(=O)C2

STK575590
Synonyms: 1- [1- hydroxy- 3,3- dimethyl- 11- (2,3,4- trimethoxyphenyl)- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 10- yl]propan- 1- one
Smiles: CCC(=O)N1C(C2=C(O)CC(CC2=Nc2c1cccc2)(C)C)c1ccc(c(c1OC)OC)OC

STK575591
Synonyms: cyclopentyl(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)C1CCCC1

STK575592
Synonyms: 6- (2,6- dimethylmorpholin- 4- yl)- 5- {(Z)- [3- (2- methoxyethyl)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 1,4- dimethyl- 2- oxo- 1,2- dihydropyridine- 3- carbonitrile
Smiles: COCCN1C(=S)S/C(=C\c2c(N3CC(C)OC(C3)C)n(C)c(=O)c(c2C)C#N)/C1=O

STK575593
Synonyms: methylN- [(4- ethylphenyl)carbamoyl]- L- phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccc(cc1)CC

STK575594
Synonyms: (2Z)- 2- {(2E)- [4- (heptyloxy)benzylidene]hydrazinylidene}- 5- methyl- 2,5- dihydro- 1,3- thiazol- 4- ol
Smiles: CCCCCCCOc1ccc(cc1)/C=N/N=C\1/N=C(C(S1)C)O

STK575598
Synonyms: 2- [4- (4- methoxyphenyl)- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 4H- 1,2,4- triazol- 3- yl]pyridine
Smiles: COc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1ccccn1

STK575599
Synonyms: N- (2- methoxyethyl)- 10,10- dimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: COCCNC(=O)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2

STK575600
Synonyms: N- [(2Z)- 3- [2- (4- fluorophenyl)ethyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2,2- dimethylpropanamide
Smiles: Fc1ccc(cc1)CCN1/C(=N/C(=O)C(C)(C)C)/SC2C1CS(=O)(=O)C2

STK575601
Synonyms: 4- methoxy- N- (pyridin- 2- ylmethyl)- 1H- indole- 2- carboxamide
Smiles: COc1cccc2c1cc([nH]2)C(=O)NCc1ccccn1

STK575602
Synonyms: N- (2,5- dichlorophenyl)- 2- {[4- (4- methoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nnc1COc1ccccc1

STK575603
Synonyms: N- [4- (acetylamino)phenyl]- 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nnc(n1N)c1cc([nH]n1)c1ccc(cc1)Cl

STK575604
Synonyms: 8- (4- chlorophenyl)- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Clc1ccc(cc1)n1c(C)c(n2c1nc1c2c(O)nc(=O)n1C)C

STK575606
Synonyms: N- [(2E)- 5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- {[5- (2- methylfuran- 3- yl)- 1,3,4- oxadiazol- 2- yl]sulfanyl}acetamide
Smiles: CCc1n[nH]/c(=N\C(=O)CSc2nnc(o2)c2ccoc2C)/s1

STK575607
Synonyms: 9- methyl- 2- (3- propoxyphenyl)- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCCOc1cccc(c1)c1nn2c(n1)c1c(nc2)sc2c1CCN(C2)C

STK575608
Synonyms: (4E)- 5- [4- (benzyloxy)- 3- ethoxyphenyl]- 1- {5- [(2,4- dichlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]pyrrolidine- 2,3- dione
Smiles: CCOc1cc(ccc1OCc1ccccc1)C1/C(=C(/c2ccc3c(c2)OCCO3)\O)/C(=O)C(=O)N1c1nnc(s1)SCc1ccc(cc1Cl)Cl

STK575610
Synonyms: 7- (2- fluorobenzyl)- 6- hydroxy- 3- methyl- 8- [4- (3- methylbutyl)piperazin- 1- yl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(CCN1CCN(CC1)c1nc2c(n1Cc1ccccc1F)c(O)nc(=O)n2C)C

STK575611
Synonyms: N- [(2E)- 3- (4- acetylphenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- (4- fluorophenyl)acetamide
Smiles: O=C(/N=C\1/SC2C(N1c1ccc(cc1)C(=O)C)CS(=O)(=O)C2)Cc1ccc(cc1)F

STK575612
Synonyms: N'- (8- ethyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)- N,N- dimethylethane- 1,2- diamine
Smiles: CCN1CCc2c(C1)sc1c2c(NCCN(C)C)nc2n1nnn2

STK575618
Synonyms: 1- {2- [(2- methoxyphenoxy)methyl]- 8- methyl- 10- phenyl- 10H- pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 9- yl}ethanone
Smiles: COc1ccccc1OCc1nn2c(n1)c1c(nc2)OC(=C(C1c1ccccc1)C(=O)C)C

STK575620
Synonyms: 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 5,6,10,11- tetrahydro- 9H- [1,4]dioxepino[2,3- g]pyrrolo[2,1- a]isoquinoline
Smiles: C1COc2c(OC1)cc1c(c2)c2cc(cn2CC1)C12CC3CC(C2)CC(C1)C3

STK575621
Synonyms: 2- [(2- methoxyphenoxy)methyl]- 11- (2- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)COc1ccccc1OC)c1ccccc1

STK575622
Synonyms: (3aR,4R,4aR,7aS,8R,8aR)- 3- (4- methoxyphenyl)- 6- (pyridin- 3- ylmethyl)- 4a,7a,8,8a- tetrahydro- 3aH- 4,8- methano[1,2]oxazolo[4,5- f]isoindole- 5,7(4H,6H)- dione
Smiles: COc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)Cc1cccnc1

STK575625
Synonyms: (3R,3'S,5'R)- 5- chloro- N- (4- methoxyphenyl)- 2- oxo- 5'- (propan- 2- yl)- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cc(Cl)cc1)C(C)C

STK575626
Synonyms: 6- (butan- 2- yl)- 1- (4- fluorophenyl)- 2- hydroxy- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: CCC(N1CNc2c(C1)c(=O)nc(n2c1ccc(cc1)F)O)C

STK575629
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- chloro- 4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)Cl)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK575631
Synonyms: 1- [5- chloro- 4- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)- 6- oxopyridazin- 1(6H)- yl]tricyclo[3.3.1.1~3,7~]decane- 2- carboxylicacid
Smiles: OC(=O)C1C2CC3CC1(CC(C2)C3)n1ncc(c(c1=O)Cl)N1CCC2(CC1)OCCO2

STK575632
Synonyms: (5E)- 4- hydroxy- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 1,3- thiazole- 2(5H)- thione
Smiles: S=C1N=C(/C(=C\C=C\c2ccccc2)/S1)O

STK575633
Synonyms: 2- [3- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)- 3- oxopropyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: COc1cc2c(cc1OC)CCN(C2C)C(=O)CCN1C(=O)c2c(C1=O)cccc2

STK575636
Synonyms: 1- [3- methoxy- 4- (2- methylpropoxy)phenyl]- 2- (4- methylpyridin- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1OCC(C)C)C1N(c2nccc(c2)C)C(=O)c2c1c(=O)c1c(o2)cccc1

STK575638
Synonyms: 2- (6- ethyl- 1,3- benzothiazol- 2- yl)- 1- (thiophen- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCc1ccc2c(c1)sc(n2)N1C(=O)c2c(C1c1cccs1)c(=O)c1c(o2)cccc1

STK575640
Synonyms: (2Z)- 2- (7,8- dihydro[1,3]dioxolo[4,5- g]isoquinolin- 5(6H)- ylidene)- 1- [3- (trifluoromethyl)phenyl]ethanone
Smiles: O=C(c1cccc(c1)C(F)(F)F)/C=C/1\NCCc2c1cc1OCOc1c2

STK575641
Synonyms: N- [N- (2,5- dimethoxyphenyl)- N'- (4,6- dimethylpyrimidin- 2- yl)carbamimidoyl]- 4- fluorobenzamide
Smiles: COc1ccc(cc1N/C(=N\c1nc(C)cc(n1)C)/NC(=O)c1ccc(cc1)F)OC

STK575642
Synonyms: 3,6- dichloro- N- (4- phenyl- 1,2,5- oxadiazol- 3- yl)- 1- benzothiophene- 2- carboxamide
Smiles: Clc1ccc2c(c1)sc(c2Cl)C(=O)Nc1nonc1c1ccccc1

STK575643
Synonyms: N- (5- chloro- 2- methylphenyl)- 2- {[4- (4- ethoxyphenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)ccc2C)nnc1c1cccc(c1)C

STK575644
Synonyms: N- (3- butoxypropyl)- 6- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]hexanamide
Smiles: CCCCOCCCNC(=O)CCCCCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

STK575645
Synonyms: 1- [1,3- dimethyl- 5- (4- methylphenyl)- 2,4- dioxo- 1,2,3,4- tetrahydro- 6H- pyrrolo[3,4- d]pyrimidin- 6- yl]urea
Smiles: Cc1ccc(cc1)c1n(NC(=O)N)cc2c1c(=O)n(C)c(=O)n2C

STK575646
Synonyms: N- [2- (dimethylamino)ethyl]- 3- (2,2- dimethyltetrahydro- 2H- pyran- 4- yl)- 3- (4- methylphenyl)propanamide
Smiles: CN(CCNC(=O)CC(c1ccc(cc1)C)C1CCOC(C1)(C)C)C

STK575647
Synonyms: methylN- [3- (2- methyl- 1H- benzimidazol- 1- yl)propanoyl]glycinate
Smiles: COC(=O)CNC(=O)CCn1c(C)nc2c1cccc2

STK575649
Synonyms: (1S,2S)- N'- {(E)- [5- (2- methoxy- 4- nitrophenyl)furan- 2- yl]methylidene}- 2- phenylcyclopropanecarbohydrazide
Smiles: COc1cc(ccc1c1ccc(o1)/C=N/NC(=O)[C@H]1C[C@@H]1c1ccccc1)[N+](=O)[O-]

STK575650
Synonyms: 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: COc1cc2CCN(Cc2cc1OC)CC(=O)Nc1cccc(c1)C(F)(F)F

STK575653
Synonyms: 5- (1,3- benzodioxol- 5- yl)- N'- {(E)- [4- (dimethylamino)phenyl]methylidene}- 1H- pyrazole- 3- carbohydrazide
Smiles: O=C(c1n[nH]c(c1)c1ccc2c(c1)OCO2)N/N=C/c1ccc(cc1)N(C)C

STK575656
Synonyms: 3- {(3E)- 3- [(4- bromophenyl)(hydroxy)methylidene]- 4,5- dioxo- 2- phenylpyrrolidin- 1- yl}benzoicacid
Smiles: Brc1ccc(cc1)/C(=C\1/C(c2ccccc2)N(C(=O)C1=O)c1cccc(c1)C(=O)O)/O

STK575657
Synonyms: 2- [(6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)methyl]- 7- methyl- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: COc1cc2CN(CCc2cc1OC)Cc1cc(=O)n2c(n1)ccc(c2)C

STK575658
Synonyms: N- (4- ethoxyphenyl)- 2- {[4- phenyl- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1cnccn1

STK575661
Synonyms: 1- (4- fluorophenyl)- 6- (1- phenylethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: Fc1ccc(cc1)n1c(S)nc(=O)c2c1NCN(C2)C(c1ccccc1)C

STK575663
Synonyms: (2E)- 3- (3- chlorophenyl)- 1- (6,7- dimethoxy- 1- methylidene- 3,4- dihydroisoquinolin- 2(1H)- yl)prop- 2- en- 1- one
Smiles: COc1cc2c(cc1OC)CCN(C2=C)C(=O)/C=C/c1cccc(c1)Cl

STK575665
Synonyms: 1- benzyl- 6- (furan- 2- ylmethyl)- 2- sulfanyl- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(S)n(c2c1CN(CN2)Cc1ccco1)Cc1ccccc1

STK575666
Synonyms: 4- [4- (2,4- dichlorobenzyl)piperazin- 1- yl]- 2- phenyl[1]benzofuro[3,2- d]pyrimidine
Smiles: Clc1ccc(c(c1)Cl)CN1CCN(CC1)c1nc(nc2c1oc1c2cccc1)c1ccccc1

STK575667
Synonyms: 4- {[(E)- (9- ethyl- 9H- carbazol- 3- yl)methylidene]amino}- 5- (4- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc2c(c1)c1ccccc1n2CC

STK575668
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccccc1

STK575669
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3- chlorophenyl)acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK575671
Synonyms: 7- (2,6- dimethylphenyl)- 3- (4- nitrophenyl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: O=C1CC2(C(=O)N1c1c(C)cccc1C)ON=C(C2)c1ccc(cc1)[N+](=O)[O-]

STK575673
Synonyms: 1,3- dimethyl- 5- {[2- oxo- 3- phenyl- 4- (piperidin- 1- yl)- 2,3- dihydro- 1,3- thiazol- 5- yl]methylidene}pyrimidine- 2,4,6(1H,3H,5H)- trione
Smiles: CN1C(=O)N(C)C(=O)C(=Cc2sc(=O)n(c2N2CCCCC2)c2ccccc2)C1=O

STK575676
Synonyms: 1',3',12- trimethyl- 15,16- dihydro- 2'H,4bH,6H,7H- spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1- a]isoquinoline- 5,5'- pyrimidine]- 2',4',6',7(1'H,3'H)- tetrone
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(N3C2c2ccccc2CC3)nc2n(c1=O)cccc2C

STK575678
Synonyms: 2- benzyl- 5,9- dimethyl- 8,9,10,11- tetrahydropyrido[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CN1CCc2c(C1)sc1c2c2nc(nn2c(n1)C)Cc1ccccc1

STK575680
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (2,2- dimethylpropanoyl)- 2'- [(4- propoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: CCCOc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C

STK575681
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,5- dichlorophenyl)acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nnc1c1cccc(c1)Cl

STK575682
Synonyms: 12- (3,4- dimethoxyphenyl)- 9,9- dimethyl- 2- [({[(1E)- 1- (thiophen- 2- yl)ethylidene]amino}oxy)methyl]- 8,9,10,12- tetrahydro- 11H- chromeno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 11- one
Smiles: COc1ccc(cc1OC)C1C2=C(Oc3c1c1nc(nn1cn3)CO/N=C(/c1cccs1)\C)CC(CC2=O)(C)C

STK575683
Synonyms: tert- butyl[(1S)- 1- (5- {[2- (4- chlorophenyl)- 2- oxoethyl]sulfanyl}- 1,3,4- oxadiazol- 2- yl)- 2- phenylethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)SCC(=O)c1ccc(cc1)Cl)Cc1ccccc1

STK575684
Synonyms: 1- (1,3- dimethyl- 2,4,6- trioxo- 1,1',2',3,3',3a',4,6- octahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinolin]- 7'- yl)- 3- methylthiourea
Smiles: CNC(=S)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

STK575685
Synonyms: 8,10,10- trimethyl- 10a- {(E)- 2- [3- (4- methylphenyl)- 1- phenyl- 1H- pyrazol- 4- yl]ethenyl}- 3,4,10,10a- tetrahydropyrimido[1,2- a]indol- 2(1H)- one
Smiles: O=C1CCN2C(N1)(/C=C/c1cn(nc1c1ccc(cc1)C)c1ccccc1)C(C)(C)c1c2ccc(c1)C

STK575686
Synonyms: 1- ethyl- 5- methoxy- 2- methyl- N- (2- phenylethyl)- 1H- indole- 3- carboxamide
Smiles: COc1ccc2c(c1)c(C(=O)NCCc1ccccc1)c(n2CC)C

STK575689
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (4- methylphenyl)ethanone
Smiles: Cc1ccc(cc1)C(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK575690
Synonyms: 5- {5- [(3- chlorobenzyl)sulfanyl]- 1,3,4- oxadiazol- 2- yl}pentan- 1- amine
Smiles: NCCCCCc1nnc(o1)SCc1cccc(c1)Cl

STK575691
Synonyms: 4- ({(E)- [3- (benzyloxy)phenyl]methylidene}amino)- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1/N=C/c1cccc(c1)OCc1ccccc1)c1ccccn1

STK575692
Synonyms: N- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 1- phenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)OC)c1ccccc1

STK575694
Synonyms: 4- ({(E)- [3- (benzyloxy)phenyl]methylidene}amino)- 5- (2- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccccc1c1n[nH]c(=S)n1/N=C/c1cccc(c1)OCc1ccccc1

STK575695
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- naphthalen- 1- ylmethylidene]- 5- (4- propoxyphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc2c1cccc2

STK575696
Synonyms: 5,6- dimethoxy- N- (naphthalen- 2- yl)- 1H- indole- 2- carboxamide
Smiles: COc1cc2[nH]c(cc2cc1OC)C(=O)Nc1ccc2c(c1)cccc2

STK575698
Synonyms: (3a'S,6a'R)- 5'- cyclopentyl- 3'- (3,4- dihydroxybenzyl)- 5- methyl- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Cc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)C1CCCC1)Cc1ccc(c(c1)O)O)C(=O)N2

STK575699
Synonyms: 8- (5- chloro- 2- methylphenyl)- 1,7- dimethyl- 3- [2- (piperidin- 1- yl)ethyl]- 1H- imidazo[2,1- f]purine- 2,4(3H,8H)- dione
Smiles: Clc1ccc(c(c1)n1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CCN1CCCCC1)C

STK575700
Synonyms: 2,11- bis(2- methoxyphenyl)- 10- methyl- 8- phenyl- 8,11- dihydropyrazolo[4',3':5,6]pyrano[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccccc1C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)c1ccccc1OC)c1ccccc1

STK575701
Synonyms: 2- (5- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl)benzoicacid
Smiles: OC(=O)c1ccccc1c1nn2c(n1)c1c(nc2C)sc2c1CCCC2

STK575702
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)C)C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl

STK575703
Synonyms: (2S)- N- (2- fluorophenyl)- 3- methyl- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: Fc1ccccc1NC(=O)[C@@H](n1nnc2c(c1=O)cccc2)C(C)C

STK575704
Synonyms: 5- [3- (propan- 2- yloxy)phenyl]- 4- {[(E)- (4- propoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(C)C

STK575705
Synonyms: 1- (4- amino- 1,2,5- oxadiazol- 3- yl)- N'- [(E)- (3- chlorophenyl)methylidene]- 5- (4- propoxyphenyl)- 1H- 1,2,3- triazole- 4- carbohydrazide
Smiles: CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)Cl

STK575706
Synonyms: 6- chloro- N- [(2Z)- 5- [(4- chlorobenzyl)sulfanyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 7- methyl- 4- oxo- 4H- chromene- 2- carboxamide
Smiles: Clc1ccc(cc1)CSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)/s1

STK575707
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(4- methylphenyl)carbonyl]- 2'- {[4- (prop- 2- en- 1- yloxy)phenyl]carbonyl}- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: C=CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK575708
Synonyms: 2- (2,4- dinitrophenyl)- 6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinoline
Smiles: COc1cc2CCN(Cc2cc1OC)c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK575709
Synonyms: N- (2- bromo- 4- methylphenyl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Br)C)CSc1nnc(n1c1ccccc1)c1ccccn1

STK575710
Synonyms: 3- (2- chlorophenyl)- 7- (naphthalen- 2- yl)- 1- oxa- 2,7- diazaspiro[4.4]non- 2- ene- 6,8- dione
Smiles: O=C1CC2(C(=O)N1c1ccc3c(c1)cccc3)ON=C(C2)c1ccccc1Cl

STK575712
Synonyms: 2- {5- [(3- methoxybenzyl)sulfanyl]- 4- phenyl- 4H- 1,2,4- triazol- 3- yl}pyridine
Smiles: COc1cccc(c1)CSc1nnc(n1c1ccccc1)c1ccccn1

STK575715
Synonyms: 8- [(5,6- dichloropyridin- 3- yl)sulfonyl]- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: Clc1cc(cnc1Cl)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK575716
Synonyms: 5- bromo- N- (furan- 2- ylmethyl)- 1H- indole- 2- carboxamide
Smiles: Brc1ccc2c(c1)cc([nH]2)C(=O)NCc1ccco1

STK575718
Synonyms: 2- {[6- (4- oxoquinazolin- 3(4H)- yl)hexanoyl]amino}benzamide
Smiles: O=C(Nc1ccccc1C(=O)N)CCCCCn1cnc2c(c1=O)cccc2

STK575719
Synonyms: (5- chloro- 1H- indol- 2- yl)(2,3- dihydro- 1H- indol- 1- yl)methanone
Smiles: Clc1ccc2c(c1)cc([nH]2)C(=O)N1CCc2c1cccc2

STK575720
Synonyms: N- (2- methoxyphenyl)- 4- (4- methoxyphenyl)- 1- (4- methylphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1OC)c1ccc(cc1)C

STK575722
Synonyms: 2- ({4- amino- 5- [5- (4- methoxyphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- bromo- 3- methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(c(c1)C)Br

STK575723
Synonyms: 2- (4- chlorophenyl)- 5,10,10- trimethyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(cc1)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2

STK575724
Synonyms: 6- (furan- 2- yl)- 9- phenyl- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: OC1=C2C(=Nc3n(C2c2ccccc2)ncn3)CC(C1)c1ccco1

STK575725
Synonyms: 2- {[3- cyano- 6- (3,4- dimethoxyphenyl)pyridin- 2- yl]sulfanyl}- N- [(2E)- 5- (propylsulfanyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: CCCSc1n[nH]/c(=N\C(=O)CSc2nc(ccc2C#N)c2ccc(c(c2)OC)OC)/s1

STK575727
Synonyms: 8- ethyl- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: CCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK575728
Synonyms: 1- amino- 4- (benzylamino)- 2- [(2- hydroxyethyl)(methyl)amino]anthracene- 9,10- dione
Smiles: OCCN(c1cc(NCc2ccccc2)c2c(c1N)C(=O)c1c(C2=O)cccc1)C

STK575729
Synonyms: 3- [(2E)- 2- (quinolin- 8- ylmethylidene)hydrazinyl]- 5H- [1,2,4]triazino[5,6- b]indole
Smiles: c1ccc2c(n1)c(/C=N/Nc1nnc3c(n1)[nH]c1c3cccc1)ccc2

STK575730
Synonyms: 4- [({[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK575731
Synonyms: (4- methoxyphenyl){4- [(1- methyl- 5- nitro- 1H- benzimidazol- 2- yl)methyl]piperazin- 1- yl}methanone
Smiles: COc1ccc(cc1)C(=O)N1CCN(CC1)Cc1nc2c(n1C)ccc(c2)[N+](=O)[O-]

STK575733
Synonyms: 2- {[6- cyano- 8,8- dimethyl- 5- (phenylamino)- 7,10- dihydro- 8H- pyrano[3,4- c][1,2,4]triazolo[4,3- a]pyridin- 3- yl]sulfanyl}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(OC)ccc1NC(=O)CSc1nnc2n1c(Nc1ccccc1)c(C#N)c1c2COC(C1)(C)C

STK575734
Synonyms: 2- {[4- amino- 5- (5- methyl- 1H- pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- cyclohexylacetamide
Smiles: O=C(NC1CCCCC1)CSc1nnc(n1N)c1cc([nH]n1)C

STK575735
Synonyms: N- [(3Z)- 6- methyl- 1- propyl- 1,2- dihydro- 3H- pyrazolo[3,4- b]quinolin- 3- ylidene]- 2,1,3- benzoxadiazole- 4- sulfonamide
Smiles: CCCn1[nH]/c(=N\S(=O)(=O)c2cccc3c2non3)/c2c1nc1ccc(cc1c2)C

STK575736
Synonyms: 4- {[(E)- (2- chloro- 6- fluorophenyl)methylidene]amino}- 5- (2- chlorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1cccc(c1/C=N/n1c(=S)[nH]nc1c1ccccc1Cl)Cl

STK575737
Synonyms: 5- amino- 11- (furan- 2- yl)- 9- oxo- 8- (thiophen- 2- yl)- 9,10,11,12- tetrahydro- 8H- quino[1,2- a]quinazoline- 7- carbonitrile
Smiles: N#CC1=c2nc(N)c3c(n2C2=C(C1c1cccs1)C(=O)CC(C2)c1ccco1)cccc3

STK575739
Synonyms: (3a'S,6a'R)- 7- chloro- 5'- (4- fluorophenyl)- 3'- (1H- indol- 3- ylmethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2Cl

STK575740
Synonyms: 2- (butylsulfanyl)- 5- hydroxy- 4- (4- hydroxy- 3- methoxyphenyl)- 4,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: CCCCSC1=C(C#N)C(C2=C(CCCC2=N1)O)c1ccc(c(c1)OC)O

STK575741
Synonyms: methyl2- [(8S,8aR,11aS)- 8- [(2,5- dimethoxyphenyl)carbonyl]- 9,11- dioxo- 8a,9,11a,11b- tetrahydro- 8H- pyrrolo[3',4':3,4]pyrrolo[2,1- a]isoquinolin- 10(11H)- yl]benzoate
Smiles: COc1ccc(c(c1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1C(=O)OC)cccc3)OC

STK575742
Synonyms: 3- butyl- 2,6- dihydroxy- 5- [(2E)- 3- (4- hydroxy- 3- methoxyphenyl)prop- 2- enoyl]pyrimidin- 4(3H)- one
Smiles: CCCCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc(c(c1)OC)O)O

STK575743
Synonyms: 8- [(4- ethylpiperazin- 1- yl)methyl]- 1,3- dimethyl- 7- (2- phenylethyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN1CCN(CC1)Cc1nc2c(n1CCc1ccccc1)c(=O)n(c(=O)n2C)C

STK575744
Synonyms: 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 5,6- dihydro[1,3]dioxolo[4,5- g]pyrrolo[2,1- a]isoquinoline
Smiles: C1Oc2c(O1)cc1c(c2)CCn2c1cc(c2)C12CC3CC(C2)CC(C1)C3

STK575748
Synonyms: 8- (3- methoxyphenyl)- 9- (5- methyl- 1,2- oxazol- 3- yl)- 8,9- dihydrobenzo[7,8]chromeno[2,3- c]pyrrole- 7,10- dione
Smiles: COc1cccc(c1)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)c2ccccc2cc1

STK575749
Synonyms: N- (1- hydroxybutan- 2- yl)- 5,10- dimethyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CCC(NC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)CC2)CO

STK575750
Synonyms: 2- ({4- amino- 5- [5- (4- chlorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1N)c1cc([nH]n1)c1ccc(cc1)Cl

STK575751
Synonyms: 3- [2- (4- methoxyphenyl)ethyl]- 10- methyl- 2- (4- methylphenyl)pyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: COc1ccc(cc1)CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccc(cc1)C

STK575752
Synonyms: 3- (3- chlorophenyl)- 4- (4- chlorophenyl)- 5- [(2,6- dichlorobenzyl)sulfanyl]- 4H- 1,2,4- triazole
Smiles: Clc1ccc(cc1)n1c(SCc2c(Cl)cccc2Cl)nnc1c1cccc(c1)Cl

STK575753
Synonyms: N- (biphenyl- 2- yl)- 2- {[5- (2- methoxyphenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccccc1c1nnc(n1c1ccccc1)SCC(=O)Nc1ccccc1c1ccccc1

STK575754
Synonyms: 3'- benzyl- 6'- hydroxy- 2,4- dimethyl- 8- nitro- 1,2,4,4a- tetrahydro- 2'H,6H- spiro[1,4- oxazino[4,3- a]quinoline- 5,5'- pyrimidine]- 2',4'(3'H)- dione
Smiles: CC1OC(C)C2N(C1)c1ccc(cc1CC12C(=NC(=O)N(C1=O)Cc1ccccc1)O)[N+](=O)[O-]

STK575755
Synonyms: N'- (8- benzyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)- N,N- diethylethane- 1,2- diamine
Smiles: CCN(CCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1)CC

STK575757
Synonyms: 4- [3- (4- chlorophenyl)- 4- phenylbutyl]morpholine
Smiles: Clc1ccc(cc1)C(Cc1ccccc1)CCN1CCOCC1

STK575759
Synonyms: 8,8- dimethyl- N- (pyridin- 4- ylmethyl)- 7,10- dihydro- 8H- pyrano[3'',4'':5',6']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 4- amine
Smiles: CC1(C)OCc2c(C1)nc1c(c2)c2c(o1)c(ncn2)NCc1ccncc1

STK575760
Synonyms: (4E)- 4- [(4- chlorophenyl)(hydroxy)methylidene]- 1- (2- hydroxyethyl)- 5- (2- nitrophenyl)pyrrolidine- 2,3- dione
Smiles: OCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccccc1[N+](=O)[O-]

STK575761
Synonyms: 1- (3,4- dimethoxyphenyl)- 7- fluoro- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: COc1cc(ccc1OC)C1N(c2noc(c2)C)C(=O)c2c1c(=O)c1c(o2)ccc(c1)F

STK575762
Synonyms: 10- (4- methoxyphenyl)- 7- phenyl- 3,4a,5,5a,8a,9,9a,10- octahydro- 5,9- methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3- f]isoindole- 2,6,8(7H)- trione
Smiles: COc1ccc(cc1)C1C2C(Sc3c1sc(=O)[nH]3)C1CC2C2C1C(=O)N(C2=O)c1ccccc1

STK575763
Synonyms: 2- cyclohexyl- 10- methyl- 3- pentylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCCCCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)C1CCCCC1

STK575764
Synonyms: (4Z)- 2- (2- fluorophenyl)- 4- ({[2- (4- methoxyphenyl)ethyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(cc1)CCN/C=C\1/c2ccccc2C(=O)N(C1=O)c1ccccc1F

STK575767
Synonyms: (E)- {1- [3- (diethylammonio)propyl]- 4,5- dioxo- 2- (3,4,5- trimethoxyphenyl)pyrrolidin- 3- ylidene}[3- fluoro- 4- (propan- 2- yloxy)phenyl]methanolate
Smiles: CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)F)OC(C)C)/[O-])/C1c1cc(OC)c(c(c1)OC)OC)CC

STK575768
Synonyms: 2- {[3- cyano- 6- hydroxy- 4- (2- methylphenyl)- 4,5- dihydropyridin- 2- yl]sulfanyl}- N- (naphthalen- 1- yl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2cccc3c2cccc3)N=C(CC1c1ccccc1C)O

STK575770
Synonyms: N- (2- ethylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1ccccc1NC(=O)CSc1nnc(n1Cc1ccco1)c1cccc(c1)C

STK575771
Synonyms: N- (3,4- dimethoxyphenyl)- 2- {[5- (2- methylphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)OC)OC)nnc1c1ccccc1C

STK575772
Synonyms: N- (4- methylphenyl)- 1,4- diphenyl- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c(c2ccccc2)c2c3n1cc(n3CCCC2)c1ccccc1

STK575773
Synonyms: 3- [(2S)- 3- methyl- 1- oxo- 1- (pyrrolidin- 1- yl)butan- 2- yl]- 1,2,3- benzotriazin- 4(3H)- one
Smiles: CC([C@H](n1nnc2c(c1=O)cccc2)C(=O)N1CCCC1)C

STK575779
Synonyms: 7- benzyl- 8- (4- ethylpiperazin- 1- yl)- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCN1CCN(CC1)c1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

STK575780
Synonyms: 3- (2- fluorophenyl)- 1',3'- dipropyl- 2,3,4,4a- tetrahydro- 1H,2'H,6H- spiro[pyrazino[1,2- a]quinoline- 5,5'- pyrimidine]- 2',4',6'(1'H,3'H)- trione
Smiles: CCCN1C(=O)N(CCC)C(=O)C2(C1=O)Cc1ccccc1N1C2CN(CC1)c1ccccc1F

STK575781
Synonyms: tert- butyl[(1S)- 1- {5- [(3,4- dichlorobenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}- 2- methylpropyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)S(=O)(=O)Cc1ccc(c(c1)Cl)Cl)C(C)C

STK575782
Synonyms: 2- {methyl[4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 7- yl]amino}ethanol
Smiles: OCCN(c1ncnc2c1sc1c2c2CCCc2c(n1)CC(C)C)C

STK575784
Synonyms: 7- (2- chlorophenyl)- 3- (4- methoxyphenyl)- 7H- pyrazolo[4,3- e][1,2,4]triazolo[4,3- c]pyrimidine
Smiles: COc1ccc(cc1)c1nnc2n1cnc1c2cnn1c1ccccc1Cl

STK575785
Synonyms: 5- (4- tert- butylphenyl)- 4- ({(E)- [4- (propan- 2- yl)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CC(c1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C)C

STK575787
Synonyms: 4- {[(E)- (4- bromophenyl)methylidene]amino}- 5- (pyridin- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccn1

STK575788
Synonyms: 2- {[5- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (propan- 2- yl)phenyl]acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(C)C)nnc1c1cccc(c1)OC

STK575789
Synonyms: 2,2,5- trimethyl- N- pentyl- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- amine
Smiles: CCCCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C

STK575790
Synonyms: (2'S,3S,3'S,10b'R)- 3'- (naphthalen- 1- ylcarbonyl)- 2'- (pyridin- 3- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: O=C([C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccnc1)C(=O)Nc1c2cccc1)cccc3)c1cccc2c1cccc2

STK575791
Synonyms: 2- (9- methoxy- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)- N- (propan- 2- yl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2CC(=O)NC(C)C

STK575792
Synonyms: 3- benzyl- 2- (propan- 2- yl)- 4H- chromeno[2,3- d]pyrimidine- 4,5(3H)- dione
Smiles: O=c1n(Cc2ccccc2)c(nc2c1c(=O)c1c(o2)cccc1)C(C)C

STK575794
Synonyms: (4E)- 1- butyl- 4- [hydroxy(4- methoxyphenyl)methylidene]- 5- phenylpyrrolidine- 2,3- dione
Smiles: CCCCN1C(c2ccccc2)/C(=C(/c2ccc(cc2)OC)\O)/C(=O)C1=O

STK575796
Synonyms: N- (3- chloro- 2- methylphenyl)- 2- {[4- (4- chlorophenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Clc1ccc(cc1)n1c(SCC(=O)Nc2cccc(c2C)Cl)nnc1c1cccc(c1)C

STK575800
Synonyms: 1- [4- (benzyloxy)phenyl]- 7- methyl- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: Cc1ccc2c(c1)c(=O)c1c(o2)C(=O)N(C1c1ccc(cc1)OCc1ccccc1)c1noc(c1)C

STK575803
Synonyms: (2Z)- 2- (4- bromobenzylidene)- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: Brc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK575806
Synonyms: N- [(2Z)- 3- (2- chlorophenyl)- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: O=C(C1CC1)/N=C/1\SC2C(N1c1ccccc1Cl)CS(=O)(=O)C2

STK575807
Synonyms: 1- (3,4- dihydro- 1H- [1,4]oxazino[4,3- a]benzimidazol- 8- yl)- 3- phenylurea
Smiles: O=C(Nc1ccccc1)Nc1ccc2c(c1)nc1n2CCOC1

STK575808
Synonyms: 5,10,10- trimethyl- N- [3- (propan- 2- yloxy)propyl]- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CC(OCCCNC(=O)c1nn2c(n1)c1c(nc2C)sc2c1CC(C)(C)OC2)C

STK575810
Synonyms: 5,10,10- trimethyl- 2- phenyl- 10,11- dihydro- 8H- pyrano[4',3':4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nc2sc3c(c2c2n1nc(n2)c1ccccc1)CC(OC3)(C)C

STK575811
Synonyms: methyl[9- (4- fluorophenyl)- 1,7- dimethyl- 2,4- dioxo- 1,4,6,7,8,9- hexahydropyrimido[2,1- f]purin- 3(2H)- yl]acetate
Smiles: COC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)c1ccc(cc1)F

STK575812
Synonyms: 2- (4- methoxyphenyl)- 3- [2- (4- methoxyphenyl)ethyl]- 10- methylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: COc1ccc(cc1)CCn1c(nc2c(c1=O)c(=O)c1c(n2C)cccc1)c1ccc(cc1)OC

STK575814
Synonyms: 5,6,7- trimethoxy- N'- [(E)- (3- methoxyphenyl)methylidene]- 1H- indole- 2- carbohydrazide
Smiles: COc1cccc(c1)/C=N/NC(=O)c1cc2c([nH]1)c(OC)c(c(c2)OC)OC

STK575815
Synonyms: 3- (furan- 2- ylmethyl)- 5- hydroxy- 2- phenyl- 5- (trifluoromethyl)- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: O=C1N(Cc2ccco2)C(=NC1(O)C(F)(F)F)c1ccccc1

STK575816
Synonyms: 2- chloro- N- [3- (4- chlorophenyl)- 4- oxo- 4H- thiochromen- 2- yl]benzamide
Smiles: Clc1ccc(cc1)c1c(NC(=O)c2ccccc2Cl)sc2c(c1=O)cccc2

STK575818
Synonyms: N- (2,4- dichlorophenyl)- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1

STK575821
Synonyms: (4E)- 4- [2,3- dihydro- 1,4- benzodioxin- 6- yl(hydroxy)methylidene]- 1- {5- [(naphthalen- 1- ylmethyl)sulfanyl]- 1,3,4- thiadiazol- 2- yl}- 5- [3- (pentyloxy)phenyl]pyrrolidine- 2,3- dione
Smiles: CCCCCOc1cccc(c1)C1N(c2nnc(s2)SCc2cccc3c2cccc3)C(=O)C(=O)/C/1=C(\c1ccc2c(c1)OCCO2)/O

STK575823
Synonyms: N- [2- (2- phenylethyl)- 1,2,3,4- tetrahydropyrazino[1,2- a]benzimidazol- 8- yl]benzamide
Smiles: O=C(c1ccccc1)Nc1ccc2c(c1)nc1n2CCN(C1)CCc1ccccc1

STK575825
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2,4,6- trimethylphenyl)acetamide
Smiles: O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK575826
Synonyms: N- (4- fluorophenyl)- 2,4- dihydroxy- 6,7- dimethoxyquinoline- 3- carboxamide
Smiles: COc1cc2nc(O)c(c(c2cc1OC)O)C(=O)Nc1ccc(cc1)F

STK575827
Synonyms: (1'S,3R,3'S,7a'S)- 1'- [(2- chlorophenyl)carbonyl]- 7''- methyl- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: Clc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cccc1C

STK575829
Synonyms: (3R,3'S,3a'S,6a'R)- 5'- (3- chloro- 2- methylphenyl)- 3'- [2- (methylsulfanyl)ethyl]- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: CSCC[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1cccc(c1C)Cl)C(=O)Nc1c2cccc1

STK575831
Synonyms: 2- (naphtho[2,1- b]furan- 1- yl)- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(Cc1coc2c1c1ccccc1cc2)NCc1cccnc1

STK575832
Synonyms: 4- [(4- oxoquinazolin- 3(4H)- yl)methyl]- N- [4- (trifluoromethyl)phenyl]cyclohexanecarboxamide
Smiles: O=C(C1CCC(CC1)Cn1cnc2c(c1=O)cccc2)Nc1ccc(cc1)C(F)(F)F

STK575834
Synonyms: N- [1- (4- chlorophenyl)- 3- methyl- 1H- pyrazol- 5- yl]- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- amine
Smiles: Clc1ccc(cc1)n1nc(cc1Nc1ncnc2c1c1CCCCc1s2)C

STK575835
Synonyms: 4- {[(E)- (3- bromo- 4- methoxyphenyl)methylidene]amino}- 5- (4- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)Br)OC

STK575838
Synonyms: ethyl4- {[({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK575839
Synonyms: 8- chloro- 4- oxo- 1,2,3,4- tetrahydrocyclopenta[c]chromen- 7- yltrans- 4- {[(tert- butoxycarbonyl)amino]methyl}cyclohexanecarboxylate
Smiles: O=C(OC(C)(C)C)NC[C@@H]1CC[C@H](CC1)C(=O)Oc1cc2oc(=O)c3c(c2cc1Cl)CCC3

STK575840
Synonyms: 1,3- dimethyl- 8- [(2- methylpiperidin- 1- yl)methyl]- 7- (2- methylpropyl)- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CC(Cn1c(CN2CCCCC2C)nc2c1c(=O)n(c(=O)n2C)C)C

STK575842
Synonyms: 2- chloro- N'- {(E)- [1- (3- methylphenyl)- 4,6- dioxo- 2- sulfanyl- 1,6- dihydropyrimidin- 5(4H)- ylidene]methyl}benzohydrazide
Smiles: Cc1cccc(c1)N1C(=NC(=O)/C(=C\NNC(=O)c2ccccc2Cl)/C1=O)S

STK575845
Synonyms: ethyl3- {[1- ({1- [(4- methylphenyl)sulfonyl]piperidin- 4- yl}carbonyl)- L- prolyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)[C@@H]1CCCN1C(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

STK575846
Synonyms: 2- (ethylsulfanyl)- 6,6- dimethyl- 9- (3,4,5- trimethoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: CCSc1nc2n(n1)C(c1cc(OC)c(c(c1)OC)OC)C1=C(O)CC(CC1=N2)(C)C

STK085967
Synonyms:
Smiles: COc1cccc2c1oc(=O)c(c2)c1csc([nH]1)Nc1ccc(cc1)F

STK072659
Synonyms:
Smiles: CCOc1ccc2c(c1)oc(=O)c(c2)c1csc([nH]1)Nc1ccc(cc1)F

STK035231
Synonyms:
Smiles: Fc1cccc(c1)Nc1scc([nH]1)c1cc2ccccc2oc1=O

STK591183
Synonyms:
Smiles: CCC([C@@H](C(=O)NC1CCCCC1)NC(=O)[C@H]1NCc2c(C1)cccc2)C

STK617014
Synonyms:
Smiles: CCC([C@@H](C(=O)NCc1ccco1)NC(=O)c1cn(CC)c2c(c1=O)cc1c(c2)OCO1)C

STK590710
Synonyms:
Smiles: CCC([C@@H](C(=O)NCc1ccc(cc1)Cl)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK598105
Synonyms:
Smiles: CCC([C@@H](c1nnc(o1)SCc1cccc(c1)Cl)N)C

STK602061
Synonyms:
Smiles: CCC([C@@H](C(=O)NCc1ccco1)NC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1)C

STK578373
Synonyms:
Smiles: CCC([C@H](C(=O)OC)NC(=O)Nc1ccccc1C)C

STK615957
Synonyms:
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)[C@H]1C[C@@H](N[C@@]21C(=O)Nc1c2cccc1Cl)C(O)C

STK568906
Synonyms:
Smiles: CCc1ccc(cc1)Nc1nc2ccccc2[nH]/c/1=N\S(=O)(=O)c1cccc2c1nsn2

STK575974
Synonyms:
Smiles: CC([C@@H]1N[C@]2([C@@H]3[C@H]1C(=O)N(C3=O)CC1CCCO1)C(=O)Nc1c2cc(Br)cc1)O

STK584215
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)[C@@H]1CC[C@H](CC1)CNC(=O)[C@@H](NC(=O)OC(C)(C)C)CC(C)C)C

STK624910
Synonyms:
Smiles: CCC([C@@H](C(=O)NCc1ccccn1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)C

STK578057
Synonyms:
Smiles: CCCNC(=O)[C@H](C(CC)C)NC(=O)N1CCn2c1nc1c2cccc1

STK621696
Synonyms:
Smiles: CCC([C@@H](C(=O)NCc1cccnc1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)C

STK617274
Synonyms:
Smiles: CCC([C@@H](C(=O)N1CCN(CC1)C)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C

STK626807
Synonyms:
Smiles: CCC([C@@H](C(=O)NC1CCCC1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)F)C

STK628691
Synonyms:
Smiles: CCC([C@@H](C(=O)Nc1cccnc1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)OC)C

STK060803
Synonyms: 9- (4- chlorophenyl)- 4- hydroxy- 7- methylthieno[2,3- b:4,5- b']dipyridin- 2(1H)- one
Smiles: Clc1ccc(cc1)c1cc(C)nc2c1c1[nH]c(=O)cc(c1s2)O

STK546027
Synonyms: N'- [(E)- (2,4- dihydroxyphenyl)methylidene]- 2- [2- (pyridin- 2- yl)- 1H- benzimidazol- 1- yl]acetohydrazide
Smiles: O=C(Cn1c(nc2c1cccc2)c1ccccn1)N/N=C/c1ccc(cc1O)O

STK575848
Synonyms: propan- 2- yl(2E)- 3- (furan- 2- yl)- 2- phenylprop- 2- enoate
Smiles: CC(OC(=O)/C(=C/c1ccco1)/c1ccccc1)C

STK575849
Synonyms: ethyl4- (5- cyano- 1,4- dimethyl- 6- oxo- 3- {(Z)- [4- oxo- 3- (propan- 2- yl)- 2- thioxo- 1,3- thiazolidin- 5- ylidene]methyl}- 1,6- dihydropyridin- 2- yl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1c(/C=C/2\SC(=S)N(C2=O)C(C)C)c(C)c(c(=O)n1C)C#N

STK575850
Synonyms: methyl4- ({8- [(dimethylamino)methyl]- 7- hydroxy- 4- oxo- 4H- chromen- 3- yl}oxy)benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2CN(C)C)O

STK575851
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(2- methoxyphenyl)carbonyl]- 2'- [(4- methylphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)C)C(=O)Nc1c2cccc1)cccc3

STK575854
Synonyms: 2- ({4- amino- 5- [5- (4- methylphenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (2- methylphenyl)acetamide
Smiles: O=C(Nc1ccccc1C)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)C

STK575855
Synonyms: (3R,3'S,3a'S,6a'R)- 3'- benzyl- 6- chloro- 5'- (3- chloro- 4- fluorophenyl)- 7- methyl- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: O=C1N(c2ccc(c(c2)Cl)F)C(=O)[C@@H]2[C@H]1[C@H](Cc1ccccc1)N[C@@]12C(=O)Nc2c1ccc(c2C)Cl

STK575857
Synonyms: 7- methyl- 3- (4- methylpiperidin- 1- yl)- 1- (pyrrolidin- 1- yl)- 5,6,7,8- tetrahydro- 2,7- naphthyridine- 4- carbonitrile
Smiles: N#Cc1c(nc(c2c1CCN(C2)C)N1CCCC1)N1CCC(CC1)C

STK575858
Synonyms: N- [3- (2- chlorophenyl)- 4- oxo- 4H- thiochromen- 2- yl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1sc2ccccc2c(=O)c1c1ccccc1Cl

STK575861
Synonyms: 4- {[(1E,2E)- 3- (2- methoxyphenyl)prop- 2- en- 1- ylidene]amino}- 5- (3- methylphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccccc1/C=C/C=N/n1c(=S)[nH]nc1c1cccc(c1)C

STK575863
Synonyms: 2- [(3a'S,6a'R)- 6- chloro- 5'- (2- methoxybenzyl)- 7- methyl- 2,4',6'- trioxo- 1,2,3',3a',4',5',6',6a'- octahydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrol]- 3'- yl]acetamide
Smiles: COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1ccc(c2C)Cl

STK575865
Synonyms: (5E)- 1- (3- chloro- 4- methylphenyl)- 5- {[1- (2- methoxyethyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: COCCn1c(C)cc(c1C)/C=C/1\C(=O)N=C(N(C1=O)c1ccc(c(c1)Cl)C)S

STK575866
Synonyms: 8,9- dimethoxy- 2- (tricyclo[3.3.1.1~3,7~]dec- 1- yl)- 5,6- dihydropyrrolo[2,1- a]isoquinoline
Smiles: COc1cc2c(cc1OC)CCn1c2cc(c1)C12CC3CC(C2)CC(C1)C3

STK575868
Synonyms: (6E)- 6- {[1- (3- chloro- 2- methylphenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]methylidene}- 5- imino- 2- [2- (morpholin- 4- yl)- 2- oxoethyl]- 5,6- dihydro- 7H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 7- one
Smiles: O=C(N1CCOCC1)Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3cccc(c3C)Cl)C)/C2=N)s1

STK575869
Synonyms: 7- butyl- 8- [(4- ethylpiperazin- 1- yl)methyl]- 1,3- dimethyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCCn1c(CN2CCN(CC2)CC)nc2c1c(=O)n(c(=O)n2C)C

STK575870
Synonyms: N- (2- methoxyethyl)- 2,2- dimethyl- 5- (propan- 2- yl)- 1,4- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 8- amine
Smiles: COCCNc1ncnc2c1oc1c2c2CC(C)(C)OCc2c(n1)C(C)C

STK575872
Synonyms: N- (3,4- dichlorophenyl)- 2- ({4- ethyl- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(c(c2)Cl)Cl)nnc1COc1ccc(cc1)C

STK575873
Synonyms: 2- [5- hydroxy- 2- (2- methylphenyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- yl]- 1H- isoindole- 1,3(2H)- dione
Smiles: Oc1nc2nc(nn2c(c1)N1C(=O)c2c(C1=O)cccc2)c1ccccc1C

STK575876
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- ethoxyphenyl)acetamide
Smiles: CCOc1ccc(cc1)NC(=O)CSc1nnc(n1CC=C)COc1ccc(cc1)Cl

STK575878
Synonyms: (E)- {1- [2- (dimethylammonio)ethyl]- 2- (2- fluorophenyl)- 4,5- dioxopyrrolidin- 3- ylidene}[3- fluoro- 4- (propan- 2- yloxy)phenyl]methanolate
Smiles: C[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(c(c2)F)OC(C)C)/[O-])/C1c1ccccc1F)C

STK575879
Synonyms: N- (2- ethoxyphenyl)- 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCOc1ccccc1NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccccc1F

STK575880
Synonyms: N- [(2Z)- 3- [2- chloro- 5- (trifluoromethyl)phenyl]- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]butanamide
Smiles: CCCC(=O)/N=C/1\SC2C(N1c1cc(ccc1Cl)C(F)(F)F)CS(=O)(=O)C2

STK575882
Synonyms: 2,4- dihydroxy- 1- (2- methoxyethyl)- 5- (2- methoxyphenyl)- 1,5- dihydro- 6H- indeno[2',1':5,6]pyrido[2,3- d]pyrimidin- 6- one
Smiles: COCCn1c(O)nc(c2c1=NC1=C(C2c2ccccc2OC)C(=O)c2c1cccc2)O

STK575884
Synonyms: 2- (9- fluoro- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)- N- [3- (methylsulfanyl)phenyl]acetamide
Smiles: CSc1cccc(c1)NC(=O)Cn1c2ccc(cc2c2c1c(=O)n1CCSc1n2)F

STK575885
Synonyms: 4- ({(2'S,3S,3'S,10b'R)- 2'- [(4- chlorophenyl)carbonyl]- 2- oxo- 1,2,2',3'- tetrahydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 3'- yl}carbonyl)phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1)Cl)C(=O)Nc1c2cccc1)cccc3

STK575886
Synonyms: (3a'S,6a'R)- 3'- benzyl- 5'- (2- methoxyethyl)- 6,7- dimethyl- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccccc2)C(=O)Nc2c1ccc(c2C)C

STK575887
Synonyms: N- [(2Z)- 5- [(4- chlorobenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]furan- 2- carboxamide
Smiles: Clc1ccc(cc1)CS(=O)(=O)c1n[nH]/c(=N/C(=O)c2ccco2)/s1

STK575889
Synonyms: 1- amino- 5- (piperidin- 1- yl)- N- (1,3- thiazol- 2- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)c1CCCCc1c(n2)N1CCCCC1)Nc1nccs1

STK575890
Synonyms: 10- (5- chloro- 2- hydroxyphenyl)- 5- (4- methoxyphenyl)- 1,3- dimethyl- 1,7,8,10- tetrahydro- 2H- pyrimido[4',5':3,4]pyrrolo[2,1- c][1,4]oxazine- 2,4(3H)- dione
Smiles: COc1ccc(cc1)c1n2CCOC(c2c2c1c(=O)n(C)c(=O)n2C)c1cc(Cl)ccc1O

STK575892
Synonyms: N- [(3- chlorophenyl)carbamoyl]- L- alanine
Smiles: O=C(N[C@H](C(=O)O)C)Nc1cccc(c1)Cl

STK575893
Synonyms: 4- ({[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}methyl)benzonitrile
Smiles: COc1ccc(cc1)n1c(SCc2ccc(cc2)C#N)nnc1c1ccccc1F

STK575894
Synonyms: (3a'S,6a'R)- 5'- (3,5- dimethylphenyl)- 3'- (1H- indol- 3- ylmethyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: Cc1cc(C)cc(c1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2

STK575898
Synonyms: 8- (3- chlorophenyl)- 1- methyl- 3- (2- methylbenzyl)- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: Clc1cccc(c1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1C

STK575899
Synonyms: 8- (3- chloro- 2- methylphenyl)- 1- methyl- 3- propyl- 7,8- dihydro- 1H- imidazo[2,1- f]purine- 2,4(3H,6H)- dione
Smiles: CCCn1c(=O)n(C)c2c(c1=O)n1CCN(c1n2)c1cccc(c1C)Cl

STK575900
Synonyms: (2Z)- 7- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 2- [(5- methylfuran- 2- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1ccc(o1)C)/C2=O

STK575901
Synonyms: N- cyclohexyl- 3,4,9,10- tetrahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline- 8(7H)- carbothioamide
Smiles: S=C(N1CCc2c(C1)cc1c(c2)OCCCO1)NC1CCCCC1

STK575903
Synonyms: (E)- 2,3- dihydro- 1,4- benzodioxin- 6- yl{2- [3- ethoxy- 4- (prop- 2- en- 1- yloxy)phenyl]- 1- [3- (1H- imidazol- 3- ium- 1- yl)propyl]- 4,5- dioxopyrrolidin- 3- ylidene}methanolate
Smiles: C=CCOc1ccc(cc1OCC)C1/C(=C(/c2ccc3c(c2)OCCO3)\[O-])/C(=O)C(=O)N1CCCn1cc[nH+]c1

STK575904
Synonyms: 2- {[5- (4- tert- butylphenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- chloro- 4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1Cl)NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

STK575905
Synonyms: 5,10- dimethyl- N- (pyridin- 3- ylmethyl)- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine- 2- carboxamide
Smiles: CC1CCc2c(C1)c1c(s2)nc(n2c1nc(n2)C(=O)NCc1cccnc1)C

STK575906
Synonyms: (3S,3a'R,8a'S,8b'S)- 5- chloro- 7- methyl- 2'- phenyl- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: Clc1cc(C)c2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1

STK575907
Synonyms: N,3- bis(2,5- dimethoxyphenyl)- 4,5- dihydro- 1,2- oxazole- 5- carboxamide
Smiles: COc1ccc(c(c1)NC(=O)C1ON=C(C1)c1cc(OC)ccc1OC)OC

STK575909
Synonyms: (3S,3a'R,8a'S,8b'S)- 5- chloro- 2'- (2,4- dimethylphenyl)- 7- methyl- 3a',6',7',8',8a',8b'- hexahydro- 1'H- spiro[indole- 3,4'- pyrrolo[3,4- a]pyrrolizine]- 1',2,3'(1H,2'H)- trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N3[C@H]2CCC3)C(=O)Nc2c1cc(Cl)cc2C

STK575911
Synonyms: (2'S,3S,3'S,10b'R)- 2'- [(2,4- dimethoxyphenyl)carbonyl]- 3'- [(4- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1ccc(cc1OC)OC)C(=O)Nc1c2cccc1)cccc3

STK575912
Synonyms: 2- (6,7- dimethoxy- 1- methyl- 3,4- dihydroisoquinolin- 2(1H)- yl)- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: COc1cc2CCN(C(c2cc1OC)C)CC(=O)Nc1cccc(c1)C(F)(F)F

STK575913
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK575914
Synonyms: N- [4- (4- chlorophenyl)- 2- (3,4- dimethylphenyl)- 6- methyl- 5- oxo- 2,5- dihydropyridazin- 3- yl]- 4- methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1n(nc(c(=O)c1c1ccc(cc1)Cl)C)c1ccc(c(c1)C)C

STK575915
Synonyms: 7'- {[(1Z)- 1- (2- hydroxy- 4,6- dioxo- 1,6- dihydropyrimidin- 5(4H)- ylidene)propyl]amino}- 1,3- dimethyl- 1',2',3',3a'- tetrahydro- 2H,5'H- spiro[pyrimidine- 5,4'- pyrrolo[1,2- a]quinoline]- 2,4,6(1H,3H)- trione
Smiles: CC/C(=C/1\C(=O)NC(=NC1=O)O)/Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

STK575916
Synonyms: 2- {[5- (3- chlorophenyl)- 4- methyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4- dimethylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1C)C)CSc1nnc(n1C)c1cccc(c1)Cl

STK575917
Synonyms: N- (4- fluorophenyl)- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)F)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1

STK575918
Synonyms: 2- {[4- (4- methoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C)nnc1COc1ccccc1

STK575921
Synonyms: N- (3- methylphenyl)- 2- {[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)C)CSc1nnc(n1c1ccc(cc1)C)c1nccnc1

STK575923
Synonyms: 4- [({[4- (4- methylphenyl)- 5- (pyrazin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetyl)amino]benzamide
Smiles: O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

STK575924
Synonyms: 9- bromo- 5- ethyl- 5- methyl- 2- phenyl- 1,10b- dihydropyrazolo[1,5- c][1,3]benzoxazine
Smiles: CCC1(C)Oc2ccc(cc2C2N1N=C(C2)c1ccccc1)Br

STK575925
Synonyms: (2S)- N- (2,5- dimethoxyphenyl)- 3- methyl- 2- (4- oxoquinazolin- 3(4H)- yl)butanamide
Smiles: COc1ccc(cc1NC(=O)[C@@H](n1cnc2c(c1=O)cccc2)C(C)C)OC

STK575926
Synonyms: (6E)- 7- imino- 2- methyl- 6- (thiophen- 2- ylmethylidene)- 6,7- dihydro- 5H- [1,2]oxazolo[2,3- a]pyrimidin- 5- one
Smiles: Cc1on2c(=NC(=O)/C(=C/c3cccs3)/C2=N)c1

STK575929
Synonyms: 5- (3- chlorophenyl)- 4- {[(E)- (2,3- dichlorophenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cccc(c1Cl)Cl

STK575933
Synonyms: N- (2,5- dimethoxybenzyl)- 6- methoxy- N- (prop- 2- en- 1- yl)- 1H- indole- 2- carboxamide
Smiles: C=CCN(C(=O)c1cc2c([nH]1)cc(cc2)OC)Cc1cc(OC)ccc1OC

STK575934
Synonyms: N- (2- methoxyphenyl)- 2- {[4- (4- methoxyphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2OC)nnc1COc1ccccc1

STK575935
Synonyms: N- [5,7- bis(4- methoxyphenyl)- 4,5,6,7- tetrahydro[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl]butanamide
Smiles: CCCC(=O)Nc1nn2c(n1)NC(CC2c1ccc(cc1)OC)c1ccc(cc1)OC

STK575936
Synonyms: 4- (4- ethoxyphenyl)- 3- [(3- fluorobenzyl)sulfanyl]- 5- (thiophen- 2- yl)- 4H- 1,2,4- triazole
Smiles: CCOc1ccc(cc1)n1c(SCc2cccc(c2)F)nnc1c1cccs1

STK575937
Synonyms: N- cyclopentyl- 2- (9- methoxy- 5- oxo- 2,3- dihydro[1,3]thiazolo[3',2':1,2]pyrimido[5,4- b]indol- 6(5H)- yl)acetamide
Smiles: COc1ccc2c(c1)c1nc3SCCn3c(=O)c1n2CC(=O)NC1CCCC1

STK575938
Synonyms: 7,7- dimethyl- 2- (3- methylphenyl)- 4- (propan- 2- ylsulfanyl)- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidine
Smiles: CC(Sc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C)C

STK575940
Synonyms: 2- {[4- amino- 5- (2,4,5,6- tetrahydrocyclopenta[c]pyrazol- 3- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1N)c1[nH]nc2c1CCC2

STK575941
Synonyms: 1- benzyl- 2- hydroxy- 6- (3- phenylpropyl)- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1CN(CCCc1ccccc1)CN2)Cc1ccccc1

STK575942
Synonyms: (5E)- 5- {1- [(2,4- dimethoxyphenyl)amino]propylidene}- 6- hydroxy- 3- phenylpyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccccc1)O)/Nc1ccc(cc1OC)OC

STK575943
Synonyms: 3- amino- N- (3,4- dichlorophenyl)- 5- oxo- 5,6,7,8- tetrahydrothieno[2,3- b]quinoline- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)cc1c(n2)CCCC1=O)Nc1ccc(c(c1)Cl)Cl

STK575945
Synonyms: N- (4- chloro- 2- methylphenyl)- 2- {[4- (furan- 2- ylmethyl)- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1C)Cl)CSc1nnc(n1Cc1ccco1)Cc1cccs1

STK575946
Synonyms: (2Z)- 2- (2,6- dichlorobenzylidene)- 7- {[4- (2- hydroxyethyl)piperazin- 1- ium- 1- yl]methyl}- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: OCCN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1c(Cl)cccc1Cl)/C2=O

STK575947
Synonyms: (1'S,3R,3'S,7a'S)- 1'- [(2- ethoxyphenyl)carbonyl]- 5''- fluoro- 5',6',7',7a'- tetrahydro- 1'H- dispiro[indole- 3,2'- pyrrolizine- 3',3''- indole]- 2,2''(1H,1''H)- dione
Smiles: CCOc1ccccc1C(=O)[C@@H]1[C@@H]2CCCN2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(F)cc1

STK575948
Synonyms: 3- [(4- bromobenzyl)sulfanyl]- 4- (furan- 2- ylmethyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazole
Smiles: Cc1ccc(cc1)OCc1nnc(n1Cc1ccco1)SCc1ccc(cc1)Br

STK575949
Synonyms: (1S,2S)- N'- [(E)- (2- hydroxy- 8- methylquinolin- 3- yl)methylidene]- 2- phenylcyclopropanecarbohydrazide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)N/N=C/c1cc2cccc(c2nc1O)C

STK575951
Synonyms: N- (2- chloro- 4,6- dimethylphenyl)- 2- {[5- (2- methoxyphenyl)- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2c(C)cc(cc2Cl)C)nnc1c1ccccc1OC

STK575953
Synonyms: 2- {[5- (3- chlorophenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N,N- diethylacetamide
Smiles: CCN(C(=O)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)Cl)CC

STK575954
Synonyms: N- (furan- 2- ylmethyl)- 2- methoxy- N- [(7- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]acetamide
Smiles: COCC(=O)N(Cc1cc2ccc(cc2[nH]c1=O)C)Cc1ccco1

STK575955
Synonyms: 2- [(8- ethyl- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- yl)amino]ethanol
Smiles: OCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)CC

STK575958
Synonyms: (3R,3'S,5'R)- N- (4- methoxyphenyl)- 5- methyl- 5'- [2- (methylsulfanyl)ethyl]- 2- oxo- 1,2- dihydrospiro[indole- 3,2'- pyrrolidine]- 3'- carboxamide
Smiles: CSCC[C@H]1C[C@@H]([C@]2(N1)C(=O)Nc1c2cc(C)cc1)C(=O)Nc1ccc(cc1)OC

STK575959
Synonyms: 8- [(3- methylphenyl)sulfonyl]- 3,4,7,8,9,10- hexahydro- 2H- [1,4]dioxepino[2,3- g]isoquinoline
Smiles: Cc1cccc(c1)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

STK575960
Synonyms: 4- {[(1E,2E)- 3- (furan- 2- yl)- 2- methylprop- 2- en- 1- ylidene]amino}- 5- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: C/C(=C\c1ccco1)/C=N/n1c(=S)[nH]nc1c1cccnc1

STK575961
Synonyms: 2- phenyl[1,2,4]triazolo[1,5- c]quinazoline- 5(6H)- thione
Smiles: S=c1[nH]c2ccccc2c2n1nc(n2)c1ccccc1

STK575964
Synonyms: N'- [(E)- (4- methoxyphenyl)methylidene]- 5- [2- (naphthalen- 1- ylmethoxy)phenyl]- 1H- pyrazole- 3- carbohydrazide
Smiles: COc1ccc(cc1)/C=N/NC(=O)c1n[nH]c(c1)c1ccccc1OCc1cccc2c1cccc2

STK575965
Synonyms: N- (butan- 2- yl)- 3- [(10aS)- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]propanamide
Smiles: CCC(NC(=O)CCN1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)C

STK575968
Synonyms: 1',3',12- trimethyl- 1,2,4,4a- tetrahydro- 2'H,6H,7H- spiro[pyrido[1'',2'':1',2']pyrimido[5',4':5,6]pyrido[2,1- c][1,4]oxazine- 5,5'- pyrimidine]- 2',4',6',7(1'H,3'H)- tetrone
Smiles: O=C1N(C)C(=O)C2(C(=O)N1C)Cc1c(N3C2COCC3)nc2n(c1=O)cccc2C

STK575969
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (3- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- fluoro- 4- methylphenyl)acetamide
Smiles: O=C(Nc1ccc(c(c1)F)C)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)C

STK575970
Synonyms: N- (biphenyl- 2- yl)- 2- {[4- phenyl- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccccc1c1ccccc1)CSc1nnc(n1c1ccccc1)c1ccccn1

STK575971
Synonyms: 3- {4- [(5E)- 5- {[5- (2,5- dichlorophenyl)furan- 2- yl]methylidene}- 4- oxo- 4,5- dihydro- 1,3- thiazol- 2- yl]piperazin- 1- yl}propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(o2)c2cc(Cl)ccc2Cl)/S1

STK575972
Synonyms: (2'S,3S,3'S,10b'R)- 2'- (1- benzofuran- 2- ylcarbonyl)- 3'- [(2- methoxyphenyl)carbonyl]- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1ccccc1C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cc4c(o1)cccc4)C(=O)Nc1c2cccc1)cccc3

STK575973
Synonyms: 2- ({4- amino- 5- [5- (4- fluorophenyl)- 1H- pyrazol- 3- yl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (4- butylphenyl)acetamide
Smiles: CCCCc1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

STK575976
Synonyms: 5- cyclohexyl- 4- ({(E)- [4- (pentyloxy)phenyl]methylidene}amino)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCCCCOc1ccc(cc1)/C=N/n1c(n[nH]c1=S)C1CCCCC1

STK575978
Synonyms: 8- {[4- (2- fluorophenyl)piperazin- 1- yl]methyl}- 1,3- dimethyl- 7- propyl- 3,7- dihydro- 1H- purine- 2,6- dione
Smiles: CCCn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=O)n(c(=O)n2C)C

STK575979
Synonyms: N- (biphenyl- 2- yl)- 2- {[4- (4- chlorophenyl)- 5- (2- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: COc1ccccc1c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccccc1c1ccccc1

STK575981
Synonyms: N- [4- (butan- 2- yl)phenyl]- 2- {[5- (3- chlorophenyl)- 4- phenyl- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccccc1)c1cccc(c1)Cl)C

STK575982
Synonyms: (5E)- 4- hydroxy- 5- [(1- phenyl- 1H- pyrrol- 2- yl)methylidene]- 1,3- thiazole- 2(5H)- thione
Smiles: S=C1N=C(/C(=C\c2cccn2c2ccccc2)/S1)O

STK575983
Synonyms: 2- {[(3- chlorophenyl)carbonyl]amino}- N- [3- (diethylamino)propyl]- 5,6- dihydro- 4H- cyclopenta[b]thiophene- 3- carboxamide
Smiles: CCN(CCCNC(=O)c1c(sc2c1CCC2)NC(=O)c1cccc(c1)Cl)CC

STK575984
Synonyms: (4E)- 2- (2,5- dimethoxyphenyl)- 4- {[(2- methoxyphenyl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: COc1ccc(c(c1)N1C(=O)/C(=C/Nc2ccccc2OC)/c2c(C1=O)cccc2)OC

STK575985
Synonyms: 2- {[4- (4- chlorophenyl)- 3- cyano- 5- hydroxy- 7,7- dimethyl- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- [2- (trifluoromethyl)phenyl]acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C(F)(F)F)N=C2C(=C(O)CC(C2)(C)C)C1c1ccc(cc1)Cl

STK575986
Synonyms: 3- (5- chloro- 2- hydroxy- 4- methylphenyl)- 4- (4- hydroxy- 3- methoxyphenyl)- 5- (3- hydroxypropyl)- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: OCCCN1C(=O)c2c(C1c1ccc(c(c1)OC)O)c([nH]n2)c1cc(Cl)c(cc1O)C

STK575987
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (3- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (2,4,6- trimethylphenyl)acetamide
Smiles: COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1c(C)cc(cc1C)C

STK575989
Synonyms: (4E)- 1- (6- ethoxy- 1,3- benzothiazol- 2- yl)- 5- (4- hydroxy- 3- methoxyphenyl)- 4- [hydroxy(2- methyl- 2,3- dihydro- 1- benzofuran- 5- yl)methylidene]pyrrolidine- 2,3- dione
Smiles: CCOc1ccc2c(c1)sc(n2)N1C(c2ccc(c(c2)OC)O)/C(=C(/c2ccc3c(c2)CC(O3)C)\O)/C(=O)C1=O

STK575990
Synonyms: (3a'S,6a'R)- 5- fluoro- 3'- (4- hydroxybenzyl)- 5'- (3- methoxypropyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cc(F)cc2

STK575991
Synonyms: N- (3- chloro- 4- methylphenyl)- 2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)acetamide
Smiles: COc1cc2CCN(Cc2cc1OC)CC(=O)Nc1ccc(c(c1)Cl)C

STK575993
Synonyms: 2- (benzylsulfanyl)- 9- (2,4,5- trimethoxyphenyl)- 5,6,7,9- tetrahydro[1,2,4]triazolo[5,1- b]quinazolin- 8- ol
Smiles: COc1cc(OC)c(cc1C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1)OC

STK575994
Synonyms: 2- {[2- (dimethylamino)ethyl]amino}- 3- (4- methoxyphenyl)- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: COc1ccc(cc1)n1c(NCCN(C)C)nc2c(c1=O)c1CCCCCc1s2

STK575995
Synonyms: N- (2,6- dimethylphenyl)- 2- ({4- (4- methoxyphenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)Nc2c(C)cccc2C)nnc1COc1ccc(cc1)C

STK575996
Synonyms: 7- chloro- 1- (4- ethoxyphenyl)- 2- (6- methoxy- 1,3- benzothiazol- 2- yl)- 1,2- dihydrochromeno[2,3- c]pyrrole- 3,9- dione
Smiles: CCOc1ccc(cc1)C1N(c2sc3c(n2)ccc(c3)OC)C(=O)c2c1c(=O)c1c(o2)ccc(c1)Cl

STK575999
Synonyms: 1- (4- ethoxyphenyl)- N- (3- methoxyphenyl)- 4- (4- methoxyphenyl)- 5,6,7,8- tetrahydro- 2a,4a- diazacyclopenta[cd]azulene- 2- carboxamide
Smiles: CCOc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)OC)cc3c1ccc(cc1)OC

STK576000
Synonyms: 3- [(Z)- (3- cyclopentyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 7- methyl- 2- (4- phenylpiperazin- 1- yl)- 4H- pyrido[1,2- a]pyrimidin- 4- one
Smiles: Cc1ccc2n(c1)c(=O)c(c(n2)N1CCN(CC1)c1ccccc1)/C=C/1\SC(=S)N(C1=O)C1CCCC1

STK576001
Synonyms: N- (2- methylphenyl)- 2- {[4- (4- methylphenyl)- 5- (phenoxymethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: Cc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C)nnc1COc1ccccc1

STK576002
Synonyms: 2- ({5- [(4- chlorophenoxy)methyl]- 4- (prop- 2- en- 1- yl)- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- (3,5- dimethoxyphenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2cc(OC)cc(c2)OC)nnc1COc1ccc(cc1)Cl

STK576003
Synonyms: [(2Z)- 4- hydroxy- 2- {(2E)- [4- (methylsulfanyl)benzylidene]hydrazinylidene}- 2,5- dihydro- 1,3- thiazol- 5- yl]aceticacid
Smiles: CSc1ccc(cc1)/C=N/N=C/1\SC(C(=N1)O)CC(=O)O

STK576004
Synonyms: 7- (3- chlorobenzyl)- 6- hydroxy- 3- methyl- 8- [4- (2- methylpropyl)piperazin- 1- yl]- 3,7- dihydro- 2H- purin- 2- one
Smiles: CC(CN1CCN(CC1)c1nc2c(n1Cc1cccc(c1)Cl)c(O)nc(=O)n2C)C

STK576006
Synonyms: [4- ({(2'S,3S,3'S,10b'R)- 3'- [(2,4- dichlorophenyl)carbonyl]- 2- oxo- 1,2,2',3'- tetrahydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2'- yl}carbonyl)phenoxy]acetonitrile
Smiles: N#CCOc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2Cl)Cl)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

STK576008
Synonyms: (4E)- 2- (3- bromophenyl)- 4- {[(1,1- dioxidotetrahydrothiophen- 3- yl)amino]methylidene}isoquinoline- 1,3(2H,4H)- dione
Smiles: Brc1cccc(c1)N1C(=O)/C(=C/NC2CCS(=O)(=O)C2)/c2c(C1=O)cccc2

STK576009
Synonyms: 6- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 2- (4- methylpiperazin- 1- yl)pyrimidin- 4- ol
Smiles: CN1CCN(CC1)c1nc(CSc2nc3c(s2)cccc3)cc(n1)O

STK576010
Synonyms: (4E)- 4- [(1- {3- [(4- fluorobenzyl)amino]- 2- hydroxypropyl}- 1H- indol- 3- yl)methylidene]- 5- methyl- 2- phenyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: OC(Cn1cc(c2c1cccc2)/C=C/1\C(=NN(C1=O)c1ccccc1)C)CNCc1ccc(cc1)F

STK576012
Synonyms: N- (4- ethylphenyl)- 2- {[5- (2- fluorophenyl)- 4- (4- methoxyphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: CCc1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccccc1F

STK576013
Synonyms: 2- {[5- (4- methoxyphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3- methylphenyl)acetamide
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)C)SCC(=O)Nc1cccc(c1)C

STK576014
Synonyms: N- [1- (1H- benzimidazol- 2- yl)- 3- methyl- 1H- pyrazol- 5- yl]- 4- (pentyloxy)benzamide
Smiles: CCCCCOc1ccc(cc1)C(=O)Nc1cc(nn1c1nc2c([nH]1)cccc2)C

STK576015
Synonyms: N- (3- methoxypropyl)- 4- (2- methylpropyl)- 2,3- dihydro- 1H- cyclopenta[4',5']pyrido[3',2':4,5]furo[3,2- d]pyrimidin- 7- amine
Smiles: COCCCNc1ncnc2c1oc1c2c2CCCc2c(n1)CC(C)C

STK576016
Synonyms: 2- ({4- (4- chlorophenyl)- 5- [(4- methylphenoxy)methyl]- 4H- 1,2,4- triazol- 3- yl}sulfanyl)- N- [2- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccccc1C(C)C)CSc1nnc(n1c1ccc(cc1)Cl)COc1ccc(cc1)C

STK576019
Synonyms: 3- [(3- fluorobenzyl)sulfanyl]- 5- (2- methoxyphenyl)- 4- phenyl- 4H- 1,2,4- triazole
Smiles: COc1ccccc1c1nnc(n1c1ccccc1)SCc1cccc(c1)F

STK576020
Synonyms: 4- ({(E)- [4- (diethylamino)phenyl]methylidene}amino)- 5- (3- ethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)N(CC)CC

STK576024
Synonyms: 4- [(6E)- 5- iminio- 7- oxo- 6- (thiophen- 2- ylmethylidene)- 6,7- dihydro- 5H- [1,3,4]thiadiazolo[3,2- a]pyrimidin- 2- yl]phenolate
Smiles: [O-]c1ccc(cc1)c1nn2c(=NC(=O)/C(=C/c3cccs3)/C2=[NH2+])s1

STK576025
Synonyms: 2- {[4- ethyl- 5- (thiophen- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- 1- (4- methylphenyl)ethanone
Smiles: CCn1c(SCC(=O)c2ccc(cc2)C)nnc1Cc1cccs1

STK576026
Synonyms: (2'S,3S,3'S,10b'R)- 3'- [(3- methoxyphenyl)carbonyl]- 2'- (pyridin- 3- ylcarbonyl)- 2',3'- dihydro- 10b'H- spiro[indole- 3,1'- pyrrolo[2,1- a]isoquinolin]- 2(1H)- one
Smiles: COc1cccc(c1)C(=O)[C@H]1N2C=Cc3c([C@@H]2[C@@]2([C@@H]1C(=O)c1cccnc1)C(=O)Nc1c2cccc1)cccc3

STK576027
Synonyms: 2- amino- 4- (5- bromo- 2- methoxyphenyl)- 5- hydroxy- 7- methyl- 4H- pyrano[3,2- c]pyridine- 3- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1cc(Br)ccc1OC)c(O)nc(c2)C

STK576029
Synonyms: dimethyl5- ({(Z)- 2- [4- (1,3- benzodioxol- 5- yl)- 1,3- thiazol- 2- yl]- 2- cyanoethenyl}amino)- 3- methylthiophene- 2,4- dicarboxylate
Smiles: N#C/C(=C/Nc1sc(c(c1C(=O)OC)C)C(=O)OC)/c1scc(n1)c1ccc2c(c1)OCO2

STK576031
Synonyms: tert- butyl[(1S)- 1- {5- [(3- chlorobenzyl)sulfonyl]- 1,3,4- oxadiazol- 2- yl}ethyl]carbamate
Smiles: O=C(OC(C)(C)C)N[C@H](c1nnc(o1)S(=O)(=O)Cc1cccc(c1)Cl)C

STK576032
Synonyms: N- (3- chlorophenyl)- 2- {[5- (3- chlorophenyl)- 4- (furan- 2- ylmethyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}acetamide
Smiles: O=C(Nc1cccc(c1)Cl)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

STK576033
Synonyms: (5E)- 3- (4- chlorophenyl)- 5- [1- (cyclopropylamino)propylidene]- 6- hydroxypyrimidine- 2,4(3H,5H)- dione
Smiles: CC/C(=C\1/C(=NC(=O)N(C1=O)c1ccc(cc1)Cl)O)/NC1CC1

STK576034
Synonyms: 2- {[5- (3- methylphenyl)- 4- (4- methylphenyl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [4- (propan- 2- yl)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1c1ccc(cc1)C)c1cccc(c1)C

STK576035
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(4- fluorophenyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]- 4- nitrobenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)[N+](=O)[O-])/C(=O)Nc1ccc(cc1)F

STK576036
Synonyms: 2- {[4- (4- chlorophenyl)- 5- (pyridin- 2- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccccn1

STK576037
Synonyms: 6- [2- (hydroxymethyl)phenyl]- 1,3- dimethyl- 5- (4- methylphenyl)- 1H- pyrrolo[3,4- d]pyrimidine- 2,4(3H,6H)- dione
Smiles: OCc1ccccc1n1cc2c(c1c1ccc(cc1)C)c(=O)n(c(=O)n2C)C

STK576038
Synonyms: 2'- hydroxy- 3- nitro- 1'- (2- phenylethyl)- 6a,7,8,9,10,11- hexahydro- 4'H,5H- spiro[azepino[1,2- a]quinoline- 6,5'- pyrimidine]- 4',6'(1'H)- dione
Smiles: OC1=NC(=O)C2(C(=O)N1CCc1ccccc1)Cc1cc(ccc1N1C2CCCCC1)[N+](=O)[O-]

STK576039
Synonyms: 8- benzyl- N- [3- (morpholin- 4- yl)propyl]- 6,7,8,9- tetrahydropyrido[4',3':4,5]thieno[3,2- e]tetrazolo[1,5- a]pyrimidin- 5- amine
Smiles: O1CCN(CC1)CCCNc1nc2nnnn2c2c1c1CCN(Cc1s2)Cc1ccccc1

STK576040
Synonyms: 3- benzyl- 2- {[3- (morpholin- 4- yl)propyl]amino}- 3,5,6,7,8,9- hexahydro- 4H- cyclohepta[4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: O=c1c2c(sc3c2CCCCC3)nc(n1Cc1ccccc1)NCCCN1CCOCC1

STK576041
Synonyms: (8aR)- 7- cycloheptyltetrahydro[1,3]thiazolo[3,4- a]pyrazine- 5,8- dione
Smiles: O=C1N(CC(=O)N2[C@H]1CSC2)C1CCCCCC1

STK576042
Synonyms: [4- (2,3- dimethylphenyl)piperazin- 1- yl](4,5,6- trimethoxy- 1H- indol- 2- yl)methanone
Smiles: COc1cc2[nH]c(cc2c(c1OC)OC)C(=O)N1CCN(CC1)c1cccc(c1C)C

STK576043
Synonyms: 2- {[3- cyano- 5- hydroxy- 4- (5- methylfuran- 2- yl)- 4,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- (4- methylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2)C)N=C2C(=C(O)CCC2)C1c1ccc(o1)C

STK576044
Synonyms: 3- [(4- {[4- (2,3- dimethylphenyl)piperazin- 1- yl]carbonyl}cyclohexyl)methyl]quinazolin- 4(3H)- one
Smiles: O=C(N1CCN(CC1)c1cccc(c1C)C)C1CCC(CC1)Cn1cnc2c(c1=O)cccc2

STK576046
Synonyms: 2- butyl- 3- [2- (3,4- dimethoxyphenyl)ethyl]- 10- methylpyrimido[4,5- b]quinoline- 4,5(3H,10H)- dione
Smiles: CCCCc1nc2c(c(=O)n1CCc1ccc(c(c1)OC)OC)c(=O)c1c(n2C)cccc1

STK576047
Synonyms: ethyl4- {[2- (4- methoxyphenyl)- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- d]pyrimidin- 4- yl]sulfanyl}butanoate
Smiles: CCOC(=O)CCCSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)OC

STK576048
Synonyms: (4Z)- 2- (4- fluorophenyl)- 4- [2- (3,4,5- trimethoxyphenyl)- 4H- chromen- 4- ylidene]- 1,3- oxazol- 5(4H)- one
Smiles: COc1cc(cc(c1OC)OC)C1=C/C(=C\2/N=C(OC2=O)c2ccc(cc2)F)/c2c(O1)cccc2

STK576049
Synonyms: (5Z)- 5- (1,3- benzodioxol- 5- ylmethylidene)- 2- (2- chlorophenyl)- 3- methyl- 3,5- dihydro- 4H- imidazol- 4- one
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/N=C(N1C)c1ccccc1Cl

STK576050
Synonyms: N- [(1Z)- 1- {1- cyano- 2- [(2- methylpropyl)amino]- 2- oxoethylidene}- 1H- isoindol- 3- yl]- 4- fluorobenzamide
Smiles: N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)F)/C(=O)NCC(C)C

STK576051
Synonyms: 5- (2- chlorophenyl)- 4- {[(E)- (4- ethoxyphenyl)methylidene]amino}- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: CCOc1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1Cl

STK576052
Synonyms: (2Z)- 2- (furan- 2- ylmethylidene)- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCOCC1)O/C(=C\c1ccco1)/C2=O

STK576054
Synonyms: 5- methoxy- N'- [(E)- (2- methoxyphenyl)methylidene]- 1H- indole- 2- carbohydrazide
Smiles: COc1ccc2c(c1)cc([nH]2)C(=O)N/N=C/c1ccccc1OC

STK576055
Synonyms: (3a'S,6a'R)- 7- chloro- 5'- (3- methoxypropyl)- 3'- (2- methylpropyl)- 3a',6a'- dihydro- 2'H- spiro[indole- 3,1'- pyrrolo[3,4- c]pyrrole]- 2,4',6'(1H,3'H,5'H)- trione
Smiles: COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(C)C)C(=O)Nc2c1cccc2Cl

STK576056
Synonyms: (4E)- 1- (furan- 2- ylmethyl)- 4- [hydroxy(3- nitrophenyl)methylidene]- 5- phenylpyrrolidine- 2,3- dione
Smiles: O/C(=C\1/C(=O)C(=O)N(C1c1ccccc1)Cc1ccco1)/c1cccc(c1)[N+](=O)[O-]