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

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STK624801
Synonyms: methyl{6- hydroxy- 2- [N'- (naphthalen- 1- yl)carbamimidamido]pyrimidin- 4- yl}acetate
Smiles: COC(=O)Cc1nc(NC(=N)Nc2cccc3c2cccc3)nc(c1)O

STK624802
Synonyms: 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 1- [4- (propan- 2- yl)phenyl]- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)c1ccc(cc1)C(C)C

STK624804
Synonyms: 5- (2,4- dihydroxyphenyl)- 4- (quinolin- 5- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Oc1ccc(c(c1)O)c1n[nH]c(=S)n1c1cccc2c1cccn2

STK624805
Synonyms: 3- (4- chlorophenyl)- 6- oxo- 5,6- dihydropyrrolo[2,1- b][1,3]thiazole- 7- carbonitrile
Smiles: N#CC1=c2scc(n2CC1=O)c1ccc(cc1)Cl

STK624808
Synonyms: N- [(trans- 4- {[4- (pyrimidin- 2- yl)piperazin- 1- yl]carbonyl}cyclohexyl)methyl]benzenesulfonamide
Smiles: O=C(N1CCN(CC1)c1ncccn1)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1

STK624809
Synonyms: 1- (1H- indol- 3- ylacetyl)- N- phenylpiperidine- 3- carboxamide
Smiles: O=C(N1CCCC(C1)C(=O)Nc1ccccc1)Cc1c[nH]c2c1cccc2

STK856630
Synonyms: (1- benzyl- 1H- imidazol- 2- yl)(2- methoxyphenyl)methanol
Smiles: COc1ccccc1C(c1nccn1Cc1ccccc1)O

STK624810
Synonyms: 3- (2- methoxyphenyl)- 2- methyl- 9- (pyridin- 3- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc1c2CN(CO1)Cc1cccnc1

STK624812
Synonyms: 5- (3- methoxyphenyl)- 2- (4- methoxyphenyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)n1[nH]c(cc1=O)c1cccc(c1)OC

STK624813
Synonyms: 2- butyl- 3- [(5- methyl- 1,2- oxazol- 3- yl)carbamoyl]- 1,1- dioxido- 2H- 1,2- benzothiazin- 4- ylacetate
Smiles: CCCCN1C(=C(OC(=O)C)c2c(S1(=O)=O)cccc2)C(=O)Nc1noc(c1)C

STK624814
Synonyms: 3- {(5E)- 5- [(6- hydroxy[1,3]dioxolo[4,5- g]quinolin- 7- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}propanoicacid
Smiles: Oc1nc2cc3OCOc3cc2cc1/C=C\1/SC(=S)N(C1=O)CCC(=O)O

STK624816
Synonyms: [8- (4- methoxybenzyl)- 1,6,7- trimethyl- 2,4- dioxo- 1,2,4,8- tetrahydro- 3H- imidazo[2,1- f]purin- 3- yl]aceticacid
Smiles: COc1ccc(cc1)Cn1c2nc3c(n2c(c1C)C)c(=O)n(c(=O)n3C)CC(=O)O

STK624818
Synonyms: 6- benzyl- 3- (3- tert- butyl- 1H- pyrazol- 5- yl)[1,2,4]triazolo[3,4- a]phthalazine
Smiles: CC(c1n[nH]c(c1)c1nnc2n1nc(Cc1ccccc1)c1c2cccc1)(C)C

STK624819
Synonyms: (2R,3R)- 1- ethyl- 2- (3- methoxyphenyl)- 5- oxopyrrolidine- 3- carboxylicacid
Smiles: CCN1C(=O)C[C@H]([C@@H]1c1cccc(c1)OC)C(=O)O

STK856632
Synonyms: methyl1- hydroxy- 9,10- dioxo- 9,10- dihydroanthracene- 2- carboxylate
Smiles: COC(=O)c1ccc2c(c1O)C(=O)c1c(C2=O)cccc1

STK624821
Synonyms: 1- (4- benzylpiperidin- 1- yl)- 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)ethanone
Smiles: O=C(N1CCC(CC1)Cc1ccccc1)Cc1nn2c(n1)nc(cc2O)C

STK624822
Synonyms: 1- (1H- indol- 6- ylcarbonyl)- N- (thiophen- 2- ylmethyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)c1ccc2c(c1)[nH]cc2)NCc1cccs1

STK624823
Synonyms: 4- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (2- fluorophenyl)- 1,3- oxazol- 5- yl]morpholine
Smiles: Fc1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)N1CCOCC1

STK624829
Synonyms: 2- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- N- (4- fluorobenzyl)acetamide
Smiles: COc1c(OC)ccc2c1C(=O)OC2CC(=O)NCc1ccc(cc1)F

STK624831
Synonyms: (5E)- 3- (2- phenylethyl)- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C/c2cnc3c(n2)cccc3)/C(=O)N1CCc1ccccc1

STK624832
Synonyms: 1- [3- (4- hydroxy- 1,6,7- trimethyl- 2- oxo- 1,2- dihydro- 8H- imidazo[2,1- f]purin- 8- yl)propyl]piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)CCCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK624835
Synonyms: N- (2,4- dichlorophenyl)- N~3~- pyrimidin- 2- yl- beta- alaninamide
Smiles: O=C(Nc1ccc(cc1Cl)Cl)CCNc1ncccn1

STK624836
Synonyms: 2- {[7- (5- bromopyridin- 2- yl)- 5,6- dimethyl- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]amino}ethanol
Smiles: OCCNc1ncnc2c1c(C)c(n2c1ccc(cn1)Br)C

STK624838
Synonyms: 2- hydroxy- 4- [(5E)- 4- oxo- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzoicacid
Smiles: S=C1S/C(=C/c2cnc3c(n2)cccc3)/C(=O)N1c1ccc(c(c1)O)C(=O)O

STK624840
Synonyms: N~6~- (4- chlorophenyl)- 7H- purine- 2,6- diamine
Smiles: Clc1ccc(cc1)Nc1nc(N)nc2c1[nH]cn2

STK624842
Synonyms: 2- tert- butyl- 7- [2- (3,4- dimethoxyphenyl)ethyl]- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cc(ccc1OC)CCn1c(C)c(c2c1ncn1c2nc(n1)C(C)(C)C)C

STK624845
Synonyms: N- (3,4- dimethoxyphenyl)- 2- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)O

STK624846
Synonyms: N- [(5- phenyl- 1,2,4- oxadiazol- 3- yl)methyl]- 1H- indole- 3- carboxamide
Smiles: O=C(c1c[nH]c2c1cccc2)NCc1noc(n1)c1ccccc1

STK624850
Synonyms: trans- N- [(2R)- 1- (3,4- dihydroisoquinolin- 2(1H)- yl)- 1- oxopropan- 2- yl]- 4- ({[(4- methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: O=C([C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)C)N[C@@H](C(=O)N1CCc2c(C1)cccc2)C

STK624852
Synonyms: 2- {4- [6- hydroxy- 1- (4- methoxyphenyl)- 3- methyl- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 4- yl]phenoxy}acetamide
Smiles: COc1ccc(cc1)n1nc(c2c1N=C(O)CC2c1ccc(cc1)OCC(=O)N)C

STK624856
Synonyms: (2Z)- 2- (3,4- dichlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: Fc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(c(c1)Cl)Cl)/C2=O

STK624857
Synonyms: 7- benzyl- 5,6- dimethyl- N- (pyridin- 4- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1n(Cc2ccccc2)c2c(c1C)c(ncn2)NCc1ccncc1

STK856637
Synonyms: (2Z)- 2- [(5- methylfuran- 2- yl)methylidene]- 8- (thiophen- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Cc1ccc(o1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1cccs1

STK624860
Synonyms: N- (3- chlorobenzyl)- 2- (7H- purin- 6- ylsulfanyl)acetamide
Smiles: O=C(NCc1cccc(c1)Cl)CSc1ncnc2c1[nH]cn2

STK624861
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 1H- indole- 3- carboxamide
Smiles: Fc1ccc2c(c1)c(CCNC(=O)c1c[nH]c3c1cccc3)c[nH]2

STK624862
Synonyms: 2- (4- benzylpiperidin- 1- yl)- 8- methyl- 4- (pyridin- 3- yl)- 4H- pyrimido[1,2- a][1,3,5]triazin- 6- ol
Smiles: Cc1cc(O)n2c(=NC(=NC2c2cccnc2)N2CCC(CC2)Cc2ccccc2)n1

STK624863
Synonyms: tert- butyl[(1- {2- oxo- 2- [(pyridin- 4- ylmethyl)amino]ethyl}cyclohexyl)methyl]carbamate
Smiles: O=C(CC1(CCCCC1)CNC(=O)OC(C)(C)C)NCc1ccncc1

STK624870
Synonyms: 2- (2,5- dimethyl- 1H- pyrrol- 1- yl)- N- (2- methoxyethyl)- 1,3- benzothiazole- 6- carboxamide
Smiles: COCCNC(=O)c1ccc2c(c1)sc(n2)n1c(C)ccc1C

STK624874
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- {[3- (4- methoxyphenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1ccc2c(c1)OCO2

STK624875
Synonyms: 2- (4- fluorophenyl)- 5- {[(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Fc1ccc(cc1)n1[nH]c(cc1=O)CSc1nnnn1c1ccccc1

STK624878
Synonyms: 4- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- (4H- 1,2,4- triazol- 4- yl)butanamide
Smiles: O=C(Nn1cnnc1)CCCn1c(O)nc2c(c1=O)cccc2

STK624879
Synonyms: N,N- dimethyl- 3- {(Z)- [5- oxo- 2- (3,4,5- trimethoxyphenyl)- 1,3- oxazol- 4(5H)- ylidene]methyl}- 1H- indole- 1- sulfonamide
Smiles: COc1cc(cc(c1OC)OC)C1=N/C(=C\c2cn(c3c2cccc3)S(=O)(=O)N(C)C)/C(=O)O1

STK624882
Synonyms: N- (2- hydroxypropyl)- 2- [(2- methyl- 4- oxo- 3- phenoxy- 4H- chromen- 7- yl)oxy]acetamide
Smiles: CC(CNC(=O)COc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C)O

STK856639
Synonyms: 6- [3- (3,4- dimethoxyphenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 5- yl]quinoxaline
Smiles: COc1ccc(cc1OC)C1=NN(C(C1)c1ccc2c(c1)nccn2)S(=O)(=O)C

STK624884
Synonyms: 1- (4- {[2- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]carbonyl}piperazin- 1- yl)ethanone
Smiles: CC(=O)N1CCN(CC1)C(=O)c1ccc2c(c1)sc(n2)n1c(C)ccc1C

STK624885
Synonyms: 4- methyl- 2- [5- (2- methylphenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 1,3- thiazole
Smiles: Cc1csc(n1)N1N=C(CC1c1ccccc1C)c1ccccc1

STK624890
Synonyms: 2- (2- phenyl- 1,3- thiazol- 4- yl)- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]acetamide
Smiles: O=C(Cc1csc(n1)c1ccccc1)Nc1ccc(cc1)Cn1cncn1

STK624893
Synonyms: (5E)- 3- (furan- 2- ylmethyl)- 5- [(1- methyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C/c2ccc3c(c2)CCCN3C)/C(=O)N1Cc1ccco1

STK624895
Synonyms: 2- (4- ethoxyphenyl)- 3- [4- (morpholin- 4- yl)phenyl]- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: CCOc1ccc(cc1)C1Nc2ccccc2C(=O)N1c1ccc(cc1)N1CCOCC1

STK624896
Synonyms: 3,6'- dimethyl- 2',3'- dihydrospiro[cyclohexane- 1,8'- cyclopenta[c]pyrano[3,2- g]chromen]- 4'(1'H)- one
Smiles: CC1CCCC2(C1)C=Cc1c(O2)c(C)c2c(c1)c1CCCc1c(=O)o2

STK624898
Synonyms: N- {[(3R)- 3- methyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindol- 3- yl]carbonyl}- beta- alanine
Smiles: OC(=O)CCNC(=O)[C@]1(C)CSC2N1C(=O)c1c2cccc1

STK624899
Synonyms: 3- [(5E)- 5- (3- methoxybenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)propanamide
Smiles: COc1cccc(c1)/C=C\1/SC(=O)N(C1=O)CCC(=O)Nc1ccc2c(c1)nccn2

STK624901
Synonyms: 3- {(4S)- 1- [2- (4- methoxyphenyl)ethyl]- 2,5- dioxoimidazolidin- 4- yl}- N- (pyridin- 2- ylmethyl)propanamide
Smiles: COc1ccc(cc1)CCN1C(=O)N[C@H](C1=O)CCC(=O)NCc1ccccn1

STK624902
Synonyms: 4- {4- hydroxy- 2- imino- 3- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 2,5- dihydro- 1H- pyrrol- 1- yl}benzenesulfonamide
Smiles: COc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)c1ccc(cc1)S(=O)(=O)N

STK624905
Synonyms: 7- [2- (2,3- dihydro- 1H- indol- 1- yl)- 2- oxoethoxy]spiro[chromene- 2,1'- cyclohexan]- 4(3H)- one
Smiles: O=C(N1CCc2c1cccc2)COc1ccc2c(c1)OC1(CC2=O)CCCCC1

STK624907
Synonyms: 3- [3- (2- methylfuran- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: Cc1occc1c1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK624909
Synonyms: 5- bromo- N- (1H- indol- 5- yl)- 1- benzofuran- 2- carboxamide
Smiles: Brc1ccc2c(c1)cc(o2)C(=O)Nc1ccc2c(c1)cc[nH]2

STK624915
Synonyms: N- (5- methyl- 1,2- oxazol- 3- yl)- 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1noc(c1)C)CCn1nnc2c(c1=O)cccc2

STK624916
Synonyms: 6- amino- 7- [2- (diethylamino)ethyl]- 3,3- dimethyl- 8- thioxo- 3,4,7,8- tetrahydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: CCN(CCn1c(N)c(C#N)c2c(c1=S)COC(C2)(C)C)CC

STK856641
Synonyms: 2- ethoxy- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- b]pyridine- 3- carbonitrile
Smiles: CCOc1nc2CC(C)(C)OCc2cc1C#N

STK624920
Synonyms: 2- {4- [5- cyano- 8- (furan- 2- yl)- 3,3- dimethyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridin- 6- yl]piperazin- 1- yl}- N- (furan- 2- ylmethyl)acetamide
Smiles: N#Cc1c(nc(c2c1CC(C)(C)OC2)c1ccco1)N1CCN(CC1)CC(=O)NCc1ccco1

STK624923
Synonyms: 3- [4- imino- 5,6- dimethyl- 7- (pyridin- 4- ylmethyl)- 4,7- dihydro- 3H- pyrrolo[2,3- d]pyrimidin- 3- yl]- N,N- dimethylpropan- 1- amine
Smiles: CN(CCCn1cnc2c(c1=N)c(C)c(n2Cc1ccncc1)C)C

STK624924
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 1- (2- chloro- 7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)NCc1ccc2c(c1)OCO2

STK856642
Synonyms: N- [2- (7,8- dimethyl- 2- oxo- 2H- chromen- 4- yl)- 1- benzofuran- 3- yl]thiophene- 2- carboxamide
Smiles: O=c1cc(c2oc3c(c2NC(=O)c2cccs2)cccc3)c2c(o1)c(C)c(cc2)C

STK624926
Synonyms: methyl[3- (4- fluorophenyl)- 7- hydroxy- 2- methylpyrazolo[1,5- a]pyrimidin- 5- yl]acetate
Smiles: COC(=O)Cc1cc(O)n2c(n1)c(c1ccc(cc1)F)c(n2)C

STK624927
Synonyms: 2- {(1E)- 5- fluoro- 2- methyl- 1- [4- (methylsulfinyl)benzylidene]- 1H- inden- 3- yl}- N- (4- methylpyridin- 2- yl)acetamide
Smiles: Fc1ccc2c(c1)C(=C(/C/2=C\c1ccc(cc1)S(=O)C)C)CC(=O)Nc1nccc(c1)C

STK624929
Synonyms: 1- (2- chlorophenyl)- 5- (6,7- dimethoxy- 1,2,3,4- tetrahydroisoquinolin- 1- yl)- 6- hydroxy- 2- thioxo- 2,3- dihydropyrimidin- 4(1H)- one
Smiles: COc1cc2c(cc1OC)CCNC2c1c(=O)[nH]c(=S)n(c1O)c1ccccc1Cl

STK624932
Synonyms: ethyl2- (4- benzylpiperazin- 1- yl)- 4- hydroxypyrimidine- 5- carboxylate
Smiles: CCOC(=O)c1cnc(nc1O)N1CCN(CC1)Cc1ccccc1

STK624933
Synonyms: 3- (2- methoxyphenyl)- 9- [2- (thiophen- 2- yl)ethyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc1c2CN(CCc2cccs2)CO1

STK624936
Synonyms: N'- [2- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- yl]- N,N- dimethylethane- 1,2- diamine
Smiles: CN(CCNc1nc(nc2c1c1CCCCc1s2)n1nc(cc1C)C)C

STK624938
Synonyms: 1- [5- (3- hydroxyphenyl)- 3'- (4- methoxyphenyl)- 1'- phenyl- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl]ethanone
Smiles: COc1ccc(cc1)c1nn(cc1C1CC(=NN1C(=O)C)c1cccc(c1)O)c1ccccc1

STK624939
Synonyms: N- [2- (dimethylamino)ethyl]- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: CN(CCNC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C

STK624940
Synonyms: 2- ethoxy- N- [2- (morpholin- 4- ylsulfonyl)ethyl]- N- (pyridin- 4- ylmethyl)pyridine- 3- carboxamide
Smiles: CCOc1ncccc1C(=O)N(Cc1ccncc1)CCS(=O)(=O)N1CCOCC1

STK624943
Synonyms: 2- [(5E)- 5- (2H- chromen- 3- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 4- (methylsulfanyl)butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C/C2=Cc3c(OC2)cccc3)/C1=O)C(=O)O

STK624944
Synonyms: 2- {[2- (5,6- dimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 3- yl)ethyl]carbamoyl}benzoicacid
Smiles: O=C(c1ccccc1C(=O)O)NCCc1coc2c1cc1c(c2)oc(=O)c(c1C)C

STK624948
Synonyms: 4- [3- (4- chlorophenyl)- 6- hydroxy- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 4- yl]benzoicacid
Smiles: Clc1ccc(cc1)c1n[nH]c2c1C(CC(=N2)O)c1ccc(cc1)C(=O)O

STK624955
Synonyms: 2- {[(2- aminoethyl)sulfanyl]methyl}- 7- chloroquinazolin- 4- ol
Smiles: NCCSCc1nc(O)c2c(n1)cc(cc2)Cl

STK624957
Synonyms: methyl2- {(3E)- 2- (2- fluorophenyl)- 3- [(4- fluorophenyl)(hydroxy)methylidene]- 4,5- dioxopyrrolidin- 1- yl}- 4- methyl- 1,3- thiazole- 5- carboxylate
Smiles: COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)F)/O)/C1c1ccccc1F

STK624962
Synonyms: 2- [8,9- dimethyl- 7- (pyridin- 2- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]naphthalen- 1- ol
Smiles: Cc1n(Cc2ccccn2)c2c(c1C)c1nc(nn1cn2)c1ccc2c(c1O)cccc2

STK856644
Synonyms: tert- butyl{[(2Z)- 2- (4- nitrobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)[N+](=O)[O-])/C2=O

STK624964
Synonyms: N- (1- hydroxy- 3- phenylpropan- 2- yl)- 1- (pyrimidin- 2- yl)piperidine- 4- carboxamide
Smiles: OCC(NC(=O)C1CCN(CC1)c1ncccn1)Cc1ccccc1

STK624966
Synonyms: 1- (3,4- dimethoxybenzyl)- 1- (furan- 2- ylmethyl)- 3- phenylurea
Smiles: COc1cc(ccc1OC)CN(C(=O)Nc1ccccc1)Cc1ccco1

STK856646
Synonyms: (2Z)- 8- (pyridin- 2- ylmethyl)- 2- (2,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(OC)c(cc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccccn1)OC

STK624971
Synonyms: 6- propyl- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]pyrimidin- 4- ol
Smiles: CCCc1cc(O)nc(n1)N1CCN(CC1)c1ccccn1

STK624973
Synonyms: 2- (dimethylamino)- 2- phenylbutyl3,4,5- trimethoxybenzoate
Smiles: CCC(c1ccccc1)(N(C)C)COC(=O)c1cc(OC)c(c(c1)OC)OC

STK624978
Synonyms: 2- [1- {7- [2- (dimethylamino)ethyl]- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl}- 3- (methylsulfanyl)propyl]- 1H- isoindole- 1,3(2H)- dione
Smiles: CSCCC(N1C(=O)c2c(C1=O)cccc2)c1nn2c(n1)c1c(nc2)n(c(c1C)C)CCN(C)C

STK624981
Synonyms: benzyl{[(2Z)- 2- (4- chlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: O=C(OCc1ccccc1)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)Cl)/C2=O

STK624984
Synonyms: 2- (4- chlorophenyl)- 5- methyl- 4- propyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: CCCc1c(C)[nH]n(c1=O)c1ccc(cc1)Cl

STK624986
Synonyms: 2- (6- chloro- 9H- carbazol- 2- yl)- N- (2- hydroxyethyl)propanamide
Smiles: OCCNC(=O)C(c1ccc2c(c1)[nH]c1c2cc(cc1)Cl)C

STK624987
Synonyms: 7- (4- hydroxyphenyl)- 3- methyl- 4- (pyridin- 3- yl)- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: Oc1ccc(cc1)C1CC(=C2C(=Nc3c(C2c2cccnc2)c(no3)C)C1)O

STK624990
Synonyms: 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- (1H- indol- 5- yl)acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccc2c(c1)cc[nH]2

STK624991
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- [2- (2- methoxyphenyl)ethyl]piperidine- 4- carboxamide
Smiles: COc1ccccc1CCNC(=O)C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2

STK624993
Synonyms: 5- methoxy- 2- [(2- methoxyphenyl)(piperidin- 1- yl)methyl]naphthalen- 1- ol
Smiles: COc1ccccc1C(c1ccc2c(c1O)cccc2OC)N1CCCCC1

STK624994
Synonyms: [(5Z)- 4- oxo- 5- (quinolin- 4- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl](phenyl)aceticacid
Smiles: S=C1S/C(=C\c2ccnc3c2cccc3)/C(=O)N1C(c1ccccc1)C(=O)O

STK624995
Synonyms: N- (4- chlorophenyl)- 1- (7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1[nH]cn2)Nc1ccc(cc1)Cl

STK625002
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- (pyridin- 2- ylmethyl)glycinamide
Smiles: O=C(NCc1ccccn1)CNC(=O)Cc1nnc(c2c1cccc2)O

STK625006
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- (2,3- dihydro- 1H- inden- 2- yl)acetamide
Smiles: O=C(NC1Cc2c(C1)cccc2)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK625007
Synonyms: 1- [(4- fluorophenyl)sulfonyl]- N- [(2Z)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]piperidine- 3- carboxamide
Smiles: Fc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)/N=c/1\scc([nH]1)C

STK625009
Synonyms: 2- hydroxy- 5- (naphthalen- 2- yl)- 1- propylpyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: CCCn1c(O)nc(=O)c2c1nccc2c1ccc2c(c1)cccc2

STK625010
Synonyms: ethyl{(2Z)- 4- (4- fluorophenyl)- 2- [(2- methylpropanoyl)imino]- 2,3- dihydro- 1,3- thiazol- 5- yl}carbamate
Smiles: CCOC(=O)Nc1s/c(=N\C(=O)C(C)C)/[nH]c1c1ccc(cc1)F

STK625011
Synonyms: 2- {[6- (difluoromethoxy)- 1H- benzimidazol- 2- yl]sulfanyl}- N- methyl- 3- oxobutanamide
Smiles: CNC(=O)C(C(=O)C)Sc1[nH]c2c(n1)ccc(c2)OC(F)F

STK625012
Synonyms: 6- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}- 7H- purine
Smiles: c1ccc(cc1)/C=C/CN1CCN(CC1)c1ncnc2c1[nH]cn2

STK625014
Synonyms: 2,3,4,9- tetramethyl- 8- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]- 7H- furo[2,3- f]chromen- 7- one
Smiles: CN1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)c1oc(c(c1c(c2)C)C)C

STK625016
Synonyms: 4- (3,4- dimethoxyphenyl)- 3,7,7- trimethyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: COc1ccc(cc1OC)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)(C)C

STK625017
Synonyms: N- (4- phenylbutan- 2- yl)- 2- (7H- purin- 6- ylsulfanyl)propanamide
Smiles: CC(NC(=O)C(Sc1ncnc2c1[nH]cn2)C)CCc1ccccc1

STK625021
Synonyms: 3- {[1- (3,4- dichlorophenyl)- 1H- tetrazol- 5- yl]methoxy}benzoicacid
Smiles: OC(=O)c1cccc(c1)OCc1nnnn1c1ccc(c(c1)Cl)Cl

STK625024
Synonyms: 2- {1- [2- (2- nitrophenoxy)ethyl]piperidin- 4- yl}- 1,3- benzothiazole
Smiles: [O-][N+](=O)c1ccccc1OCCN1CCC(CC1)c1nc2c(s1)cccc2

STK625025
Synonyms: N- benzyl- 5,6- dimethyl- 7- (pyridin- 2- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1c(C)n(c2c1c(ncn2)NCc1ccccc1)Cc1ccccn1

STK625026
Synonyms: methyl4- (5- hydroxy- 3- methyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 4- yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(O)CCCC2=Nc2c1c(C)no2

STK625029
Synonyms: methylN- {[4- (8- chloro- 5,6- dihydro- 11H- benzo[5,6]cyclohepta[1,2- b]pyridin- 11- ylidene)piperidin- 1- yl]carbonyl}- L- alaninate
Smiles: COC(=O)[C@@H](NC(=O)N1CC/C(=C/2\c3ccc(cc3CCc3c2nccc3)Cl)/CC1)C

STK625030
Synonyms: methyl2- {[(3- hydroxy- 2H- 1,4- benzothiazin- 2- yl)acetyl]amino}- 5- methylthiophene- 3- carboxylate
Smiles: COC(=O)c1cc(sc1NC(=O)CC1Sc2ccccc2N=C1O)C

STK625031
Synonyms: (6bS,9aR)- 10- [(3- methoxyphenyl)carbonyl]- 3,5- dimethyl- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: COc1cccc(c1)C(=O)C1[C@@H]2C(=O)NC(=O)[C@@H]2C2N1c1ccc(cc1C(=C2)C)C

STK625033
Synonyms: 2- [2- (3,4- dimethoxyphenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl]- N,N- dimethylethanamine
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)n(c(c1C)C)CCN(C)C

STK625038
Synonyms: 1- (1H- indol- 6- ylcarbonyl)- N- [4- (trifluoromethoxy)phenyl]piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)c1ccc2c(c1)[nH]cc2)Nc1ccc(cc1)OC(F)(F)F

STK625040
Synonyms: N- {[3- (4- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]methyl}- 1- benzofuran- 2- carboxamide
Smiles: Clc1ccc(cc1)c1noc(n1)CNC(=O)c1cc2c(o1)cccc2

STK625044
Synonyms: 6- (3,4- dimethoxyphenyl)- 2- [4- (2- methoxyphenyl)piperazin- 1- yl]pyrimidin- 4- ol
Smiles: COc1cc(ccc1OC)c1cc(O)nc(n1)N1CCN(CC1)c1ccccc1OC

STK625045
Synonyms: 7- methoxy- N- (1,3- thiazol- 2- yl)- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)Nc1nccs1

STK625046
Synonyms: 3- (4- methoxyphenyl)- 9- (propan- 2- yl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)C(C)C

STK625050
Synonyms: 2- (pyrazin- 2- yl)- 8H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: c1cnc(cn1)c1nn2c(n1)c1c[nH]nc1nc2

STK625051
Synonyms: N- [4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]cyclopropanecarboxamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)C1CC1

STK625054
Synonyms: N- [3- (5,7- dimethyl- 1,3- benzoxazol- 2- yl)- 4- hydroxyphenyl]- 2,2- dimethylpropanamide
Smiles: Cc1cc(C)c2c(c1)nc(o2)c1cc(ccc1O)NC(=O)C(C)(C)C

STK625057
Synonyms: 2- hydroxy- 5- (2- methoxyphenyl)- 1- methylpyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COc1ccccc1c1ccnc2c1c(=O)nc(n2C)O

STK856650
Synonyms: 2- {[(2Z)- 2- (4- chlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetamide
Smiles: NC(=O)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)Cl)/C2=O

STK625060
Synonyms: 3- (2- methoxyphenyl)- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc1c2CN(CO1)Cc1ccncc1

STK625062
Synonyms: [2- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl](4- ethylpiperazin- 1- yl)methanone
Smiles: CCN1CCN(CC1)C(=O)c1ccc2c(c1)sc(n2)n1c(C)ccc1C

STK625066
Synonyms: 2- (7,8- dimethoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- {[3- (4- methoxyphenyl)- 1,2,4- oxadiazol- 5- yl]methyl}acetamide
Smiles: COc1ccc(cc1)c1noc(n1)CNC(=O)Cc1c(=O)oc2c(c1C)ccc(c2OC)OC

STK625068
Synonyms: 4- tert- butyl- 10'- methyl- 6'- propyl- 8'H- spiro[cyclohexane- 1,2'- pyrano[3,2- g]chromen]- 8'- one
Smiles: CCCc1cc(=O)oc2c1cc1C=CC3(Oc1c2C)CCC(CC3)C(C)(C)C

STK625070
Synonyms: N- [(2Z)- 4- (3- chloro- 4- methoxyphenyl)- 1,3- thiazol- 2(3H)- ylidene]furan- 2- carboxamide
Smiles: COc1ccc(cc1Cl)c1cs/c(=N\C(=O)c2ccco2)/[nH]1

STK625071
Synonyms: 8- methyl- 4- [4- (methylsulfanyl)phenyl]- 2- (morpholin- 4- yl)- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: CSc1ccc(cc1)C1N=C(N=c2n1c(=O)cc([nH]2)C)N1CCOCC1

STK625077
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- [2- (3,4- dimethoxyphenyl)ethyl]propanamide
Smiles: COc1cc(CCNC(=O)CCSc2nc(Cl)nc3c2[nH]cn3)ccc1OC

STK625079
Synonyms: 2- (3,4- dimethoxybenzyl)- 8,9- dimethyl- 7- (pyridin- 4- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cc(ccc1OC)Cc1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccncc1

STK856651
Synonyms: 7- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methoxy]- 3- (2- methoxyphenyl)- 2- methyl- 4H- chromen- 4- one
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc(c2)OCc1cc(Cl)cc2c1OCOC2

STK625084
Synonyms: 1- cyclopropyl- 6,7- difluoro- N- [4- (furan- 2- yl)butan- 2- yl]- 8- methoxy- N- methyl- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)N(C(CCc1ccco1)C)C)C1CC1

STK625086
Synonyms: 2- {1- [(2- fluorophenyl)sulfonyl]pyrrolidin- 2- yl}- 1H- benzimidazole
Smiles: Fc1ccccc1S(=O)(=O)N1CCCC1c1nc2c([nH]1)cccc2

STK856652
Synonyms: 2- methyl- 5,6,7,8,9,10- hexahydrocyclohepta[b]indol- 6- ol
Smiles: Cc1ccc2c(c1)c1CCCCC(c1[nH]2)O

STK625089
Synonyms: 2- [(2,2- dimethyl- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl)oxy]- N- (4- sulfamoylbenzyl)acetamide
Smiles: O=C(COc1ccc2c(c1)OC(CC2=O)(C)C)NCc1ccc(cc1)S(=O)(=O)N

STK625090
Synonyms: 2- {(5Z)- 5- [(5- methoxy- 1H- indol- 3- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}- 4- (methylsulfanyl)butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C\c2c[nH]c3c2cc(OC)cc3)/C1=O)C(=O)O

STK625092
Synonyms: N- {(5Z)- 5- [(1- methyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}pyridine- 3- carboxamide
Smiles: S=C1S/C(=C\c2ccc3c(c2)CCCN3C)/C(=O)N1NC(=O)c1cccnc1

STK625093
Synonyms: ethyl({(2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetate
Smiles: CCOC(=O)COc1ccc2c(c1)O/C(=C/c1cn(c3c1cc(OC)cc3)C)/C2=O

STK856653
Synonyms: ethyl5- [(4- ethenylbenzyl)oxy]- 2- (4- methoxyphenyl)- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCc1ccc(cc1)C=C)cc2)c1ccc(cc1)OC

STK625101
Synonyms: (2Z)- 2- (2,5- dimethoxybenzylidene)- 8- (pyridin- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(c(c1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccccn1)OC

STK625103
Synonyms: 2- chloro- N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 7H- purin- 6- amine
Smiles: Clc1nc(Nc2ccc3c(c2)OCCO3)c2c(n1)nc[nH]2

STK625106
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (3,4- dimethoxyphenyl)propanamide
Smiles: COc1cc(ccc1OC)NC(=O)CCSc1nc(Cl)nc2c1[nH]cn2

STK625108
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- N'- [2- (piperidin- 1- ylcarbonyl)phenyl]ethanediamide
Smiles: Clc1ccc2c(c1)c(CCNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCCC1)c[nH]2

STK625109
Synonyms: 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 5- imino- 1- (3- phenylpropyl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2sc(c(n2)C)C)C(=N)N(C1)CCCc1ccccc1

STK625110
Synonyms: 4- [(1- benzylpiperidin- 4- yl)amino]tetrahydrothiophene- 3- ol1,1- dioxide
Smiles: OC1CS(=O)(=O)CC1NC1CCN(CC1)Cc1ccccc1

STK625112
Synonyms: N- (3,5- dimethoxyphenyl)- 7H- purin- 6- amine
Smiles: COc1cc(cc(c1)OC)Nc1ncnc2c1[nH]cn2

STK625116
Synonyms: 2- (2- {[(4- fluorophenyl)sulfonyl]amino}- 1,3- thiazol- 4- yl)- N- (pyridin- 3- yl)acetamide
Smiles: O=C(Cc1csc(n1)NS(=O)(=O)c1ccc(cc1)F)Nc1cccnc1

STK625117
Synonyms: (4E)- 4- [(4- bromophenyl)(hydroxy)methylidene]- 5- (2,3- dimethoxyphenyl)- 1- [2- (dimethylamino)ethyl]pyrrolidine- 2,3- dione
Smiles: COc1cccc(c1OC)C1/C(=C(/c2ccc(cc2)Br)\O)/C(=O)C(=O)N1CCN(C)C

STK856656
Synonyms: N- {2- [(4- methylphenyl)sulfonyl]- 2- (pyridin- 3- yl)ethyl}furan- 2- carboxamide
Smiles: Cc1ccc(cc1)S(=O)(=O)C(c1cccnc1)CNC(=O)c1ccco1

STK625120
Synonyms: 3,4- dihydroisoquinolin- 2(1H)- yl[2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]methanone
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)N1CCc2c(C1)cccc2

STK625121
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 2- (morpholin- 4- yl)pyridine- 4- carboxamide
Smiles: O=C(c1ccnc(c1)N1CCOCC1)NCCc1c[nH]c2c1cccc2

STK625124
Synonyms: methyl2- {[(5- bromo- 1- benzofuran- 2- yl)carbonyl]amino}- 4,5- dimethoxybenzoate
Smiles: COC(=O)c1cc(OC)c(cc1NC(=O)c1oc2c(c1)cc(cc2)Br)OC

STK625125
Synonyms: 7- [2- (4- ethylpiperazin- 1- yl)- 2- oxoethoxy]- 2- methyl- 3- phenyl- 4H- chromen- 4- one
Smiles: CCN1CCN(CC1)C(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK625129
Synonyms: [(5E)- 5- {[2- (methoxycarbonyl)- 1H- indol- 3- yl]methylidene}- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]aceticacid
Smiles: COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)CC(=O)O)cccc2

STK625131
Synonyms: (5Z)- 3- (3,4- dimethylphenyl)- 6- hydroxy- 5- (2,4,6- trimethoxybenzylidene)pyrimidine- 2,4(3H,5H)- dione
Smiles: COc1cc(OC)c(c(c1)OC)/C=C\1/C(=NC(=O)N(C1=O)c1ccc(c(c1)C)C)O

STK625133
Synonyms: 2,5,6- trihydroxy- 5- (5- hydroxy- 3- propyl- 1H- pyrazol- 4- yl)pyrimidin- 4(5H)- one
Smiles: CCCc1n[nH]c(c1C1(O)C(=NC(=NC1=O)O)O)O

STK625134
Synonyms: 1- (4- fluorophenyl)tetrahydro- 1H- thieno[3,4- d]imidazole- 2(3H)- thione5,5- dioxide
Smiles: S=C1NC2C(N1c1ccc(cc1)F)CS(=O)(=O)C2

STK625135
Synonyms: tert- butyl{[(2Z)- 2- (4- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)Br)/C2=O

STK856661
Synonyms: methyl{2- methoxy- 4- [(Z)- (6- methoxy- 3- oxo- 1- benzofuran- 2(3H)- ylidene)methyl]phenoxy}acetate
Smiles: COC(=O)COc1ccc(cc1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OC

STK625137
Synonyms: 8,9- dimethyl- 2- phenyl- 7- (pyridin- 2- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1c(C)c2c(n1Cc1ccccn1)ncn1c2nc(n1)c1ccccc1

STK625140
Synonyms: 2,4- dichloro- N- [2- (methylsulfamoyl)ethyl]- N- (pyridin- 2- ylmethyl)benzamide
Smiles: CNS(=O)(=O)CCN(C(=O)c1ccc(cc1Cl)Cl)Cc1ccccn1

STK625141
Synonyms: 3- (3,4- dimethoxyphenyl)- 9- (4- fluorobenzyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc1c2CN(CO1)Cc1ccc(cc1)F

STK625143
Synonyms: N- {(2S)- 1- [(4- chlorophenyl)amino]- 1- oxopropan- 2- yl}- 4- (1H- indol- 2- ylcarbonyl)piperazine- 1- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C

STK625145
Synonyms: S- (8- methoxy- 2- methylquinolin- 4- yl)cysteine
Smiles: Cc1cc(SCC(C(=O)O)N)c2c(n1)c(OC)ccc2

STK625146
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- N~3~- (2- chloro- 7H- purin- 6- yl)- beta- alaninamide
Smiles: O=C(CCNc1nc(Cl)nc2c1[nH]cn2)NCCc1c[nH]c2c1cc(Cl)cc2

STK625147
Synonyms: 7- (4- methoxyphenyl)- 2- methyl- 5- phenyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine
Smiles: COc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)C)c1ccccc1

STK625148
Synonyms: N- (2- chlorophenyl)- 2- (7H- purin- 6- ylsulfanyl)propanamide
Smiles: O=C(C(Sc1ncnc2c1[nH]cn2)C)Nc1ccccc1Cl

STK625151
Synonyms: 4- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- (1H- indol- 5- yl)butanamide
Smiles: O=C(Nc1ccc2c(c1)cc[nH]2)CCCn1c(O)nc2c(c1=O)cccc2

STK625153
Synonyms: 4- amino- N'- [(5E)- 9,9- dimethyl- 1,2,3,4,10,11- hexahydro- 5H,9H- benzo[c]pyrano[3,2- g]chromen- 5- ylidene]butanehydrazide
Smiles: NCCCC(=O)N/N=c\1/oc2cc3OC(C)(C)CCc3cc2c2c1CCCC2

STK856665
Synonyms: (2Z)- 2- (3- methoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: COc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)F

STK625158
Synonyms: 6- (4- bromobenzyl)- 2- ethyl- 5- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCc1nn2c(c1c1ccccc1)nc(c(c2O)Cc1ccc(cc1)Br)C

STK625159
Synonyms: 7- (5- bromopyridin- 2- yl)- 8,9- dimethyl- 2- (thiophen- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Brc1ccc(nc1)n1c(C)c(c2c1ncn1c2nc(n1)c1cccs1)C

STK625160
Synonyms: 7- {4- [4- (2,3- dichlorophenyl)piperazin- 1- yl]butoxy}- 3,4- dihydroquinolin- 2(1H)- one
Smiles: O=C1CCc2c(N1)cc(cc2)OCCCCN1CCN(CC1)c1cccc(c1Cl)Cl

STK856666
Synonyms: (2Z)- 2- (4- fluorobenzylidene)- 8- (pyridin- 4- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Fc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccncc1

STK625162
Synonyms: N- [2- hydroxy- 3- (3- methoxypropyl)- 4- oxo- 3,4- dihydrobenzo[g]pteridin- 8- yl]acetamide
Smiles: COCCCn1c(O)nc2c(c1=O)nc1c(n2)cc(cc1)NC(=O)C

STK625163
Synonyms: (2E)- 6- [(2- fluorobenzyl)oxy]- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: O=C1/C(=C\c2cn(c3c2cccc3)C)/Oc2c1ccc(c2)OCc1ccccc1F

STK625168
Synonyms: N~2~- (2- chloro- 7H- purin- 6- yl)- N- (4- methoxybenzyl)glycinamide
Smiles: COc1ccc(cc1)CNC(=O)CNc1nc(Cl)nc2c1[nH]cn2

STK625170
Synonyms: N~3~- (diphenylacetyl)- N- [2- (1H- indol- 3- yl)ethyl]- beta- alaninamide
Smiles: O=C(NCCc1c[nH]c2c1cccc2)CCNC(=O)C(c1ccccc1)c1ccccc1

STK625173
Synonyms: ethyl7- (2,4- dimethoxyphenyl)- 2- [(2- methoxy- 2- oxoethyl)sulfanyl]- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1OC)OC)nc([nH]2)SCC(=O)OC

STK856667
Synonyms: 2- {4- [3- (4- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]butyl}- 1H- benzimidazole
Smiles: Clc1ccc(cc1)c1noc(n1)CCCCc1nc2c([nH]1)cccc2

STK625177
Synonyms: 8- {3- [4- (4- fluorophenyl)piperazin- 1- yl]propyl}- 4- hydroxy- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Fc1ccc(cc1)N1CCN(CC1)CCCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK625183
Synonyms: 6- acetyl- 3- benzyl- 5- methyl- 1- [2- (morpholin- 4- yl)ethyl]thieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: CC(=O)c1sc2c(c1C)c(=O)n(c(=O)n2CCN1CCOCC1)Cc1ccccc1

STK856668
Synonyms: 3- (2- methoxyphenoxy)- 4- oxo- 4H- chromen- 7- ylmorpholine- 4- carboxylate
Smiles: COc1ccccc1Oc1coc2c(c1=O)ccc(c2)OC(=O)N1CCOCC1

STK625184
Synonyms: 2- ({(2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetamide
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OCC(=O)N

STK625186
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (2- methoxyphenyl)- N- [3- (morpholin- 4- yl)propyl]- 1,3- oxazol- 5- amine
Smiles: COc1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCCN1CCOCC1

STK625188
Synonyms: 2- [3- (4- fluorophenyl)- 5,9- dimethyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl]- N- [2- (1H- imidazol- 5- yl)ethyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)F)NCCc1cnc[nH]1

STK625189
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 2- (2- methyl- 1,3- thiazol- 4- yl)acetamide
Smiles: O=C(Cc1csc(n1)C)NCCc1c[nH]c2c1cccc2

STK625190
Synonyms: 5,8- dimethyl- 4- [4- (4- nitrophenyl)piperazin- 1- yl]- 5H- pyrimido[5,4- b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1n2C)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STK625192
Synonyms: 1- (1,3- benzodioxol- 5- ylmethyl)- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)Cc1ccc2c(c1)OCO2

STK625193
Synonyms: N- {2- [(4- methoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 5- yl}- 2- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)acetamide
Smiles: COc1ccc(cc1)C(=O)c1oc2c(c1C)cc(cc2)NC(=O)Cn1nnc2c(c1=O)cccc2

STK625194
Synonyms: (5E)- 5- (furan- 2- ylmethylidene)- 3- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CN1CCN(CC1)C(=O)CN1C(=S)S/C(=C/c2ccco2)/C1=O

STK625195
Synonyms: N- (pyridin- 2- yl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)Nc1ccccn1

STK625196
Synonyms: 3- (2- methoxyphenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl(2E)- 3- phenylprop- 2- enoate
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc(c2)OC(=O)/C=C/c1ccccc1

STK625199
Synonyms: N- (3,4- dimethoxybenzyl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: COc1cc(CNC(=O)c2ccc3c(c2)sc(n3)n2cccc2)ccc1OC

STK625200
Synonyms: N- (furan- 2- ylmethyl)- 2- [(12- oxo- 6,7,8,9,10,12- hexahydroazepino[2,1- b]quinazolin- 2- yl)oxy]acetamide
Smiles: O=C(NCc1ccco1)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1

STK856670
Synonyms: ethyl{[(2Z)- 2- (3- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)O/C(=C\c1cccc(c1)F)/C2=O

STK625201
Synonyms: 3- (4- methoxyphenoxy)- 9- (tetrahydrofuran- 2- ylmethyl)- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)Oc1c(=O)c2ccc3c(c2oc1C(F)(F)F)CN(CO3)CC1CCCO1

STK856671
Synonyms: {[(2Z)- 2- (2- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetonitrile
Smiles: N#CCOc1ccc2c(c1)O/C(=C\c1ccccc1F)/C2=O

STK625203
Synonyms: N- [7- (1H- indol- 3- yl)- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl]- 2,4- dimethoxybenzamide
Smiles: COc1cc(OC)ccc1C(=O)NC1=C(C)N=c2n(C1c1c[nH]c3c1cccc3)nc[nH]2

STK625205
Synonyms: 2- {(1E)- 5- fluoro- 2- methyl- 1- [4- (methylsulfinyl)benzylidene]- 1H- inden- 3- yl}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CC1=C(C)/C(=C\c2ccc(cc2)S(=O)C)/c2c1cc(F)cc2

STK625208
Synonyms: 2- {[3- (4- chlorophenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(Nc1nccs1)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK625209
Synonyms: 7- [(4- methoxybenzyl)oxy]- 3- (2- methoxyphenyl)- 2- methyl- 4H- chromen- 4- one
Smiles: COc1ccc(cc1)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1OC)C

STK625211
Synonyms: N- {(2S)- 1- oxo- 1- [(3- phenylpropyl)amino]propan- 2- yl}- 1- (phenylsulfonyl)piperidine- 3- carboxamide
Smiles: C[C@@H](C(=O)NCCCc1ccccc1)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1

STK625217
Synonyms: 4- (methylsulfanyl)- 2- [(5Z)- 4- oxo- 5- (quinoxalin- 5- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C\c2cccc3c2nccn3)/C1=O)C(=O)O

STK625218
Synonyms: N- cyclopropyl- Nalpha- ({1- [(4- methoxyphenyl)sulfonyl]piperidin- 3- yl}carbonyl)- L- phenylalaninamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)N[C@H](C(=O)NC1CC1)Cc1ccccc1

STK625219
Synonyms: 4- (2- chloro- 6- fluorophenyl)- 3- phenyl- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: OC1=Nc2[nH]nc(c2C(C1)c1c(F)cccc1Cl)c1ccccc1

STK856672
Synonyms: (2Z)- 2- [(3- methylthiophen- 2- yl)methylidene]- 6- (2- oxopropoxy)- 1- benzofuran- 3(2H)- one
Smiles: CC(=O)COc1ccc2c(c1)O/C(=C\c1sccc1C)/C2=O

STK625223
Synonyms: ethyl(8,8- dimethyl- 4- oxo- 8,9- dihydro- 4H- pyrano[3',4':5,6]pyrido[2,3- d]pyrimidin- 3(6H)- yl)acetate
Smiles: CCOC(=O)Cn1cnc2c(c1=O)cc1c(n2)CC(OC1)(C)C

STK625226
Synonyms: 9- [2- (3- phenyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl)ethyl]- 9H- carbazole
Smiles: c1ccc(cc1)c1nnc2n1nc(s2)CCn1c2ccccc2c2c1cccc2

STK625227
Synonyms: N- [(4- hydroxyphthalazin- 1- yl)acetyl]asparticacid
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)O)CC(=O)O

STK625229
Synonyms: [(7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)sulfanyl]acetonitrile
Smiles: N#CCSc1nn2c(n1)nc(cc2O)C

STK625230
Synonyms: 2,8,9- trimethyl- 5- (pyrrolidin- 1- yl)thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nc2n(n1)c(nc1c2c(C)c(s1)C)N1CCCC1

STK625232
Synonyms: trans- N- {2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 2- oxoethyl}- 4- ({[(4- methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: OCCN1CCN(CC1)C(=O)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)C

STK625236
Synonyms: 2- (2- fluorophenoxy)- N- [(2Z)- 5- (methylsulfonyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]propanamide
Smiles: O=C(C(Oc1ccccc1F)C)/N=c\1/[nH]nc(s1)S(=O)(=O)C

STK625237
Synonyms: 4- [4- (1H- indol- 3- yl)butanoyl]- N- {(2S)- 1- [(3- methoxyphenyl)amino]- 1- oxopropan- 2- yl}piperazine- 1- carboxamide
Smiles: COc1cccc(c1)NC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)CCCc1c[nH]c2c1cccc2)C

STK625240
Synonyms: N- (2,4- dimethoxyphenyl)- 3- [(4S)- 2,5- dioxo- 1- (2- phenylethyl)imidazolidin- 4- yl]propanamide
Smiles: COc1cc(OC)ccc1NC(=O)CC[C@@H]1NC(=O)N(C1=O)CCc1ccccc1

STK625242
Synonyms: N- cyclopropyl- N'- (2- {[2- (1H- indol- 3- yl)ethyl]carbamoyl}phenyl)ethanediamide
Smiles: O=C(C(=O)Nc1ccccc1C(=O)NCCc1c[nH]c2c1cccc2)NC1CC1

STK625248
Synonyms: 2- {[3- (2- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (tetrahydrofuran- 2- ylmethyl)acetamide
Smiles: COc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)NCC1CCCO1

STK856673
Synonyms: 3- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl)- N- [2- (1H- indol- 3- yl)ethyl]propanamide
Smiles: O=C(CCc1c(C)nc2n(c1O)ncn2)NCCc1c[nH]c2c1cccc2

STK625251
Synonyms: N- [2- (4- chlorophenyl)ethyl]- 2- (7H- purin- 6- ylsulfanyl)propanamide
Smiles: O=C(C(Sc1ncnc2c1[nH]cn2)C)NCCc1ccc(cc1)Cl

STK625257
Synonyms: N- (3- chloro- 4- fluorophenyl)- 5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccc(c(c1)Cl)F)N1C(=O)C(CS1(=O)=O)(C)C

STK625258
Synonyms: (2Z)- 2- (1,3- benzodioxol- 5- ylmethylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- fluorobenzoate
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/Oc2c1ccc(c2)OC(=O)c1ccccc1F

STK625262
Synonyms: (3aS,6aS)- 3- [(4- methoxyphenyl)carbonyl]- 5- [3- (trifluoromethyl)phenyl]- 3a,6a- dihydropyrrolo[3,4- c]pyrazole- 4,6(1H,5H)- dione
Smiles: COc1ccc(cc1)C(=O)C1=NN[C@H]2[C@@H]1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F

STK625263
Synonyms: N- [3- (2- oxopyrrolidin- 1- yl)propyl]- N'- (pyridin- 4- yl)ethanediamide
Smiles: O=C1CCCN1CCCNC(=O)C(=O)Nc1ccncc1

STK625264
Synonyms: 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl]- 3- (pyrazin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2c1cnccn1)C

STK625266
Synonyms: 3- (3- cyclopropyl- 1H- pyrazol- 5- yl)- 9- fluoro[1,2,4]triazolo[4,3- c]quinazoline
Smiles: Fc1ccc2c(c1)c1nnc(n1cn2)c1[nH]nc(c1)C1CC1

STK625267
Synonyms: ethyl1- ({1- [N- (phenylcarbonyl)glycyl]piperidin- 4- yl}carbonyl)piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)C(=O)C1CCN(CC1)C(=O)CNC(=O)c1ccccc1

STK625271
Synonyms: N- (3- carbamoyl- 5,6- dihydro- 4H- cyclopenta[b]thiophen- 2- yl)piperazine- 1- carboxamide
Smiles: O=C(N1CCNCC1)Nc1sc2c(c1C(=O)N)CCC2

STK625273
Synonyms: 1- (4- chlorobenzyl)- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Clc1ccc(cc1)CN1CC(=C(C1=N)c1scc(n1)C)O

STK625276
Synonyms: N- [2- (6- ethyl- 2- oxo- 2H- chromen- 4- yl)- 1- benzofuran- 3- yl]- 2- fluorobenzamide
Smiles: CCc1ccc2c(c1)c(cc(=O)o2)c1oc2c(c1NC(=O)c1ccccc1F)cccc2

STK625277
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- (4- methoxyphenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)c1nnc2n1nc(s2)c1cncc(c1)Br

STK856677
Synonyms: N- [2- (cyclohex- 1- en- 1- yl)ethyl]- 7H- purin- 6- amine
Smiles: C1CCC(=CC1)CCNc1ncnc2c1[nH]cn2

STK625279
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (3- fluorophenyl)acetamide
Smiles: O=C(Nc1cccc(c1)F)CSc1nc(Cl)nc2c1[nH]cn2

STK625280
Synonyms: [1- (2- chloro- 7H- purin- 6- yl)piperidin- 4- yl](4- methylpiperazin- 1- yl)methanone
Smiles: CN1CCN(CC1)C(=O)C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2

STK625282
Synonyms: 6,7- dimethoxy- N- {(2S)- 1- oxo- 1- [(pyridin- 4- ylmethyl)amino]propan- 2- yl}- 1- phenyl- 3,4- dihydroisoquinoline- 2(1H)- carboxamide
Smiles: COc1cc2c(cc1OC)CCN(C2c1ccccc1)C(=O)N[C@H](C(=O)NCc1ccncc1)C

STK625284
Synonyms: 4- {(5E)- 5- [(6- chloro[1,3]dioxolo[4,5- g]quinolin- 7- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}butanoicacid
Smiles: OC(=O)CCCN1C(=O)/C(=C\c2cc3cc4OCOc4cc3nc2Cl)/SC1=S

STK856678
Synonyms: 3,7- diacetyl- 1- methyl- 5- phenyl- 3,7- diazabicyclo[3.3.1]nonan- 9- one
Smiles: CC(=O)N1CC2(CN(CC(C1)(C2=O)C)C(=O)C)c1ccccc1

STK625286
Synonyms: [4- (1,2- benzothiazol- 3- yl)piperazin- 1- yl](1H- indol- 3- yl)methanone
Smiles: O=C(c1c[nH]c2c1cccc2)N1CCN(CC1)c1nsc2c1cccc2

STK625287
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2- {[3- (4- methoxyphenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1ccc2c(c1)OCCO2

STK625288
Synonyms: N- (3- methoxypropyl)- 2- (pyrrolidin- 1- yl)- 7,8- dihydro- 6H- thiopyrano[3,2- d]pyrimidin- 4- amine
Smiles: COCCCNc1nc(nc2c1SCCC2)N1CCCC1

STK625289
Synonyms: 4- (1H- benzimidazol- 2- yl)- 1- {[(E)- furan- 2- ylmethylidene]amino}- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2nc3c([nH]2)cccc3)C(=N)N(C1)/N=C/c1ccco1

STK625292
Synonyms: (2Z)- 2- (3- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: Brc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C(C)(C)C

STK625293
Synonyms: 2- [(5- hydroxy- 2,2- dimethyl- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl)oxy]- N- [(2Z)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(/N=c/1\scc([nH]1)C)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

STK625294
Synonyms: 4- {[2- (azepan- 1- ylsulfonyl)ethyl](pyridin- 2- ylmethyl)amino}- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N(Cc1ccccn1)CCS(=O)(=O)N1CCCCCC1

STK625299
Synonyms: 4- (1H- benzimidazol- 2- yl)- 5- imino- 1- {[(E)- (2,3,4- trimethoxyphenyl)methylidene]amino}- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: COc1c(OC)ccc(c1OC)/C=N/N1CC(=C(C1=N)c1nc2c([nH]1)cccc2)O

STK625304
Synonyms: 2- (3- chlorophenyl)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N- methyl- 1,3- oxazol- 5- amine
Smiles: CNc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1cccc(c1)Cl

STK625305
Synonyms: (2Z)- 2- (2,4- dichlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: Fc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1Cl)Cl)/C2=O

STK856679
Synonyms: 1- [(3,5- dimethyl- 1,2- oxazol- 4- yl)sulfonyl]- N- phenylprolinamide
Smiles: O=C(C1CCCN1S(=O)(=O)c1c(C)noc1C)Nc1ccccc1

STK625311
Synonyms: N- [1- (2- chlorobenzyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]cyclopropanecarboxamide
Smiles: O=C(C1CC1)NC1(N=C(N(C1=O)Cc1ccccc1Cl)O)C(F)(F)F

STK625317
Synonyms: 2- methyl- 7- {2- oxo- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]ethoxy}- 3- phenyl- 4H- chromen- 4- one
Smiles: O=C(N1CCN(CC1)c1ccccn1)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK625319
Synonyms: 1- {[4- (2- oxopyrrolidin- 1- yl)phenyl]sulfonyl}- N- (2- phenylethyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)S(=O)(=O)c1ccc(cc1)N1CCCC1=O)NCCc1ccccc1

STK625322
Synonyms: (2Z)- 2- (2- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylbenzenesulfonate
Smiles: CCOc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1

STK625324
Synonyms: N- {(2S)- 1- [(2,4- dichlorobenzyl)amino]- 1- oxopropan- 2- yl}- 6,7- dimethoxy- 3,4- dihydroisoquinoline- 2(1H)- carboxamide
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)N[C@H](C(=O)NCc1ccc(cc1Cl)Cl)C

STK625325
Synonyms: 1- (1H- indol- 6- ylcarbonyl)- N- (4- methoxyphenyl)piperidine- 3- carboxamide
Smiles: COc1ccc(cc1)NC(=O)C1CCCN(C1)C(=O)c1ccc2c(c1)[nH]cc2

STK625326
Synonyms: (5Z)- 1- (2,3- dimethylphenyl)- 2- hydroxy- 5- {[5- (pyrrolidin- 1- yl)furan- 2- yl]methylidene}pyrimidine- 4,6(1H,5H)- dione
Smiles: O=C1N=C(O)N(C(=O)/C/1=C\c1ccc(o1)N1CCCC1)c1cccc(c1C)C

STK625328
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OS(=O)(=O)c1ccc(cc1)Cl

STK625331
Synonyms: (2Z)- 2- (2,5- dimethoxybenzylidene)- 8- [2- (morpholin- 4- yl)ethyl]- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CCN2CCOCC2)CO1)OC

STK625332
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)acetamide
Smiles: O=C(Cc1nn2c(n1)nc(cc2O)C)NCCc1c[nH]c2c1cc(Cl)cc2

STK625333
Synonyms: N- (1- benzylpiperidin- 4- yl)- 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]acetamide
Smiles: O=C(NC1CCN(CC1)Cc1ccccc1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK625335
Synonyms: N- benzyl- N'- (2- phenyl- 1H- indol- 3- yl)ethanediamide
Smiles: O=C(C(=O)NCc1ccccc1)Nc1c([nH]c2c1cccc2)c1ccccc1

STK625336
Synonyms: 2- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (1H- indol- 5- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)Nc1ccc2c(c1)cc[nH]2

STK625337
Synonyms: 2- {3- [(4- bromophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}- 1H- indole
Smiles: Brc1ccc(cc1)OCc1nnc2n1nc(s2)c1cc2c([nH]1)cccc2

STK856683
Synonyms: ethyl2- (4- methoxyphenyl)- 5- [2- oxo- 2- (propan- 2- yloxy)ethoxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(OCC(=O)OC(C)C)cc2)c1ccc(cc1)OC

STK625339
Synonyms: 2- [(2- methyl- 4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(Nc1nccs1)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK625340
Synonyms: 1- [5- (3- hydroxyphenyl)- 1'- phenyl- 3'- (thiophen- 2- yl)- 3,4- dihydro- 1'H,2H- 3,4'- bipyrazol- 2- yl]ethanone
Smiles: Oc1cccc(c1)C1=NN(C(C1)c1cn(nc1c1cccs1)c1ccccc1)C(=O)C

STK856684
Synonyms: (4- methoxyphenyl)[3- (4- methoxyphenyl)- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]methanone
Smiles: COc1ccc(cc1)C1=NN(C(C1)c1ccc2c(c1)nccn2)C(=O)c1ccc(cc1)OC

STK625342
Synonyms: 2- {[(2E)- 4- methylquinazolin- 2(1H)- ylidene]amino}- 1,5,6,7- tetrahydro- 4H- cyclopenta[d]pyrimidin- 4- one
Smiles: O=c1nc(/N=c\2/nc(C)c3c([nH]2)cccc3)[nH]c2c1CCC2

STK625344
Synonyms: 2,8,9- trimethyl- 5- (morpholin- 4- yl)thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1nc2n(n1)c(nc1c2c(C)c(s1)C)N1CCOCC1

STK625347
Synonyms: N- [4- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2,5- oxadiazol- 3- yl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1nonc1c1ccc2c(c1)CCCC2

STK625350
Synonyms: (2Z)- 3- oxo- 2- [4- (propan- 2- yl)benzylidene]- 2,3- dihydro- 1- benzofuran- 6- yl4- methoxybenzenesulfonate
Smiles: COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)C)/C2=O

STK625352
Synonyms: N- (4- chlorophenyl)- 3- (6- nitro- 1H- benzimidazol- 2- yl)propanamide
Smiles: O=C(Nc1ccc(cc1)Cl)CCc1nc2c([nH]1)cc(cc2)[N+](=O)[O-]

STK625355
Synonyms: 3- butyl- 5,6- dimethylfuro[2,3- d]pyrimidin- 4(3H)- imine
Smiles: CCCCn1cnc2c(c1=N)c(C)c(o2)C

STK625356
Synonyms: (2Z)- 2- (3,4- dimethoxybenzylidene)- 8- (tetrahydrofuran- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)CC1CCCO1

STK625357
Synonyms: 2- (3,4- dimethylphenyl)- 5- propyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: CCCc1[nH]n(c(=O)c1)c1ccc(c(c1)C)C

STK625358
Synonyms: 6- (benzylsulfanyl)- 3,3- dimethyl- 8- (piperazin- 1- yl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(SCc2ccccc2)nc(c2c1CC(C)(C)OC2)N1CCNCC1

STK625359
Synonyms: 2- [(4,6- dimethylquinazolin- 2- yl)amino]- 6- [(pyrimidin- 2- ylsulfanyl)methyl]pyrimidin- 4- ol
Smiles: Oc1nc(nc(c1)CSc1ncccn1)Nc1nc(C)c2c(n1)ccc(c2)C

STK625360
Synonyms: 1- methyl- 1- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]- 3- phenylurea
Smiles: O=c1cc(CN(C(=O)Nc2ccccc2)C)c2c([nH]1)cccc2

STK625362
Synonyms: (2R)- 2- [(diphenylacetyl)amino]- 2- phenyl- N- (pyridin- 2- ylmethyl)ethanamide
Smiles: O=C([C@@H](c1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1)NCc1ccccn1

STK625363
Synonyms: 8- [(dimethylammonio)methyl]- 4- methyl- 2- oxo- 2H- chromen- 7- olate
Smiles: C[NH+](Cc1c([O-])ccc2c1oc(=O)cc2C)C

STK625364
Synonyms: 1- (9H- purin- 6- yl)- N- (2,2,6,6- tetramethylpiperidin- 4- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)NC1CC(C)(C)NC(C1)(C)C

STK625367
Synonyms: 2- ({8,9- dimethyl- 7- [2- (morpholin- 4- yl)ethyl]- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl}methyl)- 1H- isoindole- 1,3(2H)- dione
Smiles: O=C1N(Cc2nn3c(n2)c2c(nc3)n(c(c2C)C)CCN2CCOCC2)C(=O)c2c1cccc2

STK625370
Synonyms: (3Z)- 6- chloro- 1- (morpholin- 4- ylmethyl)- 3- (3,4,5- trimethoxybenzylidene)- 1,3- dihydro- 2H- indol- 2- one
Smiles: COc1c(OC)cc(cc1OC)/C=C/1\C(=O)N(c2c1ccc(c2)Cl)CN1CCOCC1

STK625374
Synonyms: methyl6- hydroxy- 2- methyl- 4- [(3,4,5- trimethoxyphenyl)carbamoyl]- 4,5- dihydropyridine- 3- carboxylate
Smiles: COC(=O)C1=C(C)N=C(CC1C(=O)Nc1cc(OC)c(c(c1)OC)OC)O

STK625377
Synonyms: (2Z)- 8- (4- methoxybenzyl)- 2- (2,3,4- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)CN1COc2c(C1)c1O/C(=C\c3ccc(c(c3OC)OC)OC)/C(=O)c1cc2

STK625378
Synonyms: (2Z)- 2- (4- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: Fc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)Cl

STK625380
Synonyms: N- (2- methylpropyl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(CNC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C

STK625382
Synonyms: 1- {[6- (3- chloro- 4- fluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]methyl}- 2- methyl- 1H- benzimidazole
Smiles: Fc1ccc(cc1Cl)c1nn2c(s1)nnc2Cn1c(C)nc2c1cccc2

STK625384
Synonyms: (2Z)- 2- (3- fluorobenzylidene)- 6- {[(2E)- 3- phenylprop- 2- en- 1- yl]oxy}- 1- benzofuran- 3(2H)- one
Smiles: Fc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC/C=C/c1ccccc1

STK856688
Synonyms: 2- (3,4- dimethoxyphenyl)- 6- fluoro- 4H- chromen- 4- one
Smiles: COc1cc(ccc1OC)c1cc(=O)c2c(o1)ccc(c2)F

STK625389
Synonyms: (3E)- 1- (3- chlorophenyl)- 3- [(5- nitrothiophen- 2- yl)methylidene]pyrrolidine- 2,5- dione
Smiles: Clc1cccc(c1)N1C(=O)C/C(=C\c2ccc(s2)[N+](=O)[O-])/C1=O

STK625391
Synonyms: 2- {[(4- hydroxyquinazolin- 2- yl)methyl]sulfanyl}- N- (2- methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSCc1nc(O)c2c(n1)cccc2

STK625394
Synonyms: 1H- imidazol- 1- yl[2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]methanone
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)n1ccnc1

STK625396
Synonyms: N- [2- ({[1- (9H- purin- 6- yl)piperidin- 4- yl]carbonyl}amino)ethyl]pyridine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)NCCNC(=O)c1ccncc1

STK625397
Synonyms: 8- (2,5- dimethoxyphenyl)- 7- (4- fluorophenyl)- 4- hydroxy- 1- methyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: COc1ccc(c(c1)n1c(cn2c1nc1c2c(O)nc(=O)n1C)c1ccc(cc1)F)OC

STK625401
Synonyms: N- [2- (2,4- dichlorophenyl)ethyl]- 2- (7H- purin- 6- ylsulfanyl)propanamide
Smiles: O=C(C(Sc1ncnc2c1[nH]cn2)C)NCCc1ccc(cc1Cl)Cl

STK625402
Synonyms: 3- {2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 2- oxoethyl}- 7,8- dihydroxy- 4- methyl- 2H- chromen- 2- one
Smiles: O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)Cc1c(=O)oc2c(c1C)ccc(c2O)O

STK625404
Synonyms: (2- {[(3,4,5- trimethoxyphenyl)carbonyl]oxy}phenyl)phosphonicacid
Smiles: COc1cc(cc(c1OC)OC)C(=O)Oc1ccccc1P(=O)(O)O

STK625408
Synonyms: 4- (1H- benzimidazol- 2- yl)- 1- {[(E)- (3- hydroxyphenyl)methylidene]amino}- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Oc1cccc(c1)/C=N/N1CC(=C(C1=N)c1nc2c([nH]1)cccc2)O

STK625409
Synonyms: 2- {1- [2- (3- methoxyphenoxy)ethyl]piperidin- 4- yl}- 1,3- benzothiazole
Smiles: COc1cccc(c1)OCCN1CCC(CC1)c1nc2c(s1)cccc2

STK625410
Synonyms: 6- (3- bromo- 4- fluorophenyl)- 3- [(4- fluorophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1)OCc1nnc2n1nc(s2)c1ccc(c(c1)Br)F

STK625411
Synonyms: 2- [(Z)- (6- methoxy- 3- oxo- 1- benzofuran- 2(3H)- ylidene)methyl]phenylmorpholine- 4- carboxylate
Smiles: COc1ccc2c(c1)O/C(=C\c1ccccc1OC(=O)N1CCOCC1)/C2=O

STK625413
Synonyms: N,N'- di(2,3- dihydro- 1,4- benzodioxin- 6- yl)- 7H- purine- 2,6- diamine
Smiles: C1COc2c(O1)ccc(c2)Nc1nc(Nc2ccc3c(c2)OCCO3)c2c(n1)nc[nH]2

STK625416
Synonyms: ({[(Z)- (6,7- dimethoxyisoquinolin- 1- yl)(3,4- dimethoxyphenyl)methylidene]amino}oxy)(3- fluorophenyl)methanone
Smiles: COc1cc(ccc1OC)/C(=N/OC(=O)c1cccc(c1)F)/c1nccc2c1cc(OC)c(c2)OC

STK625417
Synonyms: 3- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- [3- (morpholin- 4- yl)propyl]propanamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NCCCN1CCOCC1

STK625425
Synonyms: N- [(2Z)- 5- {[(4- chlorophenyl)carbonyl]amino}- 4- (4- methylphenyl)- 1,3- thiazol- 2(3H)- ylidene]furan- 2- carboxamide
Smiles: Cc1ccc(cc1)c1[nH]/c(=N/C(=O)c2ccco2)/sc1NC(=O)c1ccc(cc1)Cl

STK625428
Synonyms: 2- {[5,6- dimethyl- 7- (4- methylpyridin- 2- yl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]amino}ethanol
Smiles: OCCNc1ncnc2c1c(C)c(n2c1nccc(c1)C)C

STK625433
Synonyms: (2Z)- 2- (4- tert- butylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methoxybenzenesulfonate
Smiles: COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)(C)C)/C2=O

STK625434
Synonyms: 9- (2- chloro- 6- fluorobenzyl)- 3- (2- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc1c2CN(CO1)Cc1c(F)cccc1Cl

STK856692
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 4- phenyl- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]sulfanyl}- 4H- 1,2,4- triazole
Smiles: c1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1ccc2c(c1)OCO2

STK625436
Synonyms: (3E)- 2- (propan- 2- yl)- 3- [(1,3,5- trimethyl- 1H- pyrazol- 4- yl)methylidene]- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: O=C1/C(=C\c2c(C)nn(c2C)C)/N(C(C)C)S(=O)(=O)c2c1cccc2

STK625437
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- 1- (pyrimidin- 2- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncccn1)NCCCn1cncc1

STK625438
Synonyms: 3- [2- (1,3- benzothiazol- 2- yl)- 5- methyl- 3- oxo- 2,3- dihydro- 1H- pyrazol- 4- yl]- 1- (4- ethylphenyl)pyrrolidine- 2,5- dione
Smiles: CCc1ccc(cc1)N1C(=O)CC(C1=O)c1c(C)[nH]n(c1=O)c1nc2c(s1)cccc2

STK625439
Synonyms: ethyl{2- [N'- (2,4- dimethoxyphenyl)carbamimidamido]- 6- hydroxypyrimidin- 4- yl}acetate
Smiles: CCOC(=O)Cc1nc(NC(=N)Nc2ccc(cc2OC)OC)nc(c1)O

STK856693
Synonyms: (2Z)- 2- (2,4- dimethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C(C)(C)C

STK625443
Synonyms: 1,2,3,4- tetrahydrocyclohepta[b]indolium- 6- olate
Smiles: [O-]c1ccccc2c1[nH+]c1c2CCCC1

STK625444
Synonyms: (2Z)- 2- (furan- 2- ylmethylidene)- 8- (pyridin- 3- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccco2)/Oc2c1ccc1c2CN(CO1)Cc1cccnc1

STK625446
Synonyms: 2- methyl- 3- [(1- methyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methyl]- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: OC1C(Cc2ccc3c(c2)CCCN3C)N(C)S(=O)(=O)c2c1cccc2

STK625447
Synonyms: N- [1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 3- (4- methoxyphenyl)- 1H- pyrazol- 5- yl]furan- 2- carboxamide
Smiles: COc1ccc(cc1)c1nn(c(c1)NC(=O)c1ccco1)C1CCS(=O)(=O)C1

STK625449
Synonyms: N,N- dimethyl- 2- [4- (methylcarbamothioyl)piperazin- 1- yl]acetamide
Smiles: CNC(=S)N1CCN(CC1)CC(=O)N(C)C

STK625454
Synonyms: N- cyclopropyl- 1- (1H- indol- 6- ylcarbonyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)c1ccc2c(c1)[nH]cc2)NC1CC1

STK625455
Synonyms: 2- [(5Z)- 5- (3- methoxybenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)acetamide
Smiles: COc1cccc(c1)/C=C/1\SC(=S)N(C1=O)CC(=O)Nc1ccc2c(c1)nccn2

STK856694
Synonyms: 3- (2- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl4- methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1ccc2c(c1)occ(c2=O)c1ccccc1OC

STK625458
Synonyms: N- [(2Z)- 3- methyl- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 3- phenylpropanamide
Smiles: O=C(/N=C/1\SC2C(N1C)CS(=O)(=O)C2)CCc1ccccc1

STK625460
Synonyms: 2- [(6- benzyl- 5- hydroxy- 1,2,4- triazin- 3- yl)sulfanyl]- N- (2,6- dichlorophenyl)acetamide
Smiles: O=C(Nc1c(Cl)cccc1Cl)CSc1nnc(c(n1)O)Cc1ccccc1

STK856695
Synonyms: 3- amino- 6- (2,4- difluorophenyl)thieno[2,3- b]pyridine- 2- carbonitrile
Smiles: N#Cc1sc2c(c1N)ccc(n2)c1ccc(cc1F)F

STK625461
Synonyms: trans- 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)- N- {2- oxo- 2- [(pyridin- 3- ylmethyl)amino]ethyl}cyclohexanecarboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)NCC(=O)NCc1cccnc1

STK625462
Synonyms: methyl3- [(1- benzofuran- 2- ylcarbonyl)amino]- 6- methoxy- 1H- indole- 2- carboxylate
Smiles: COc1ccc2c(c1)[nH]c(c2NC(=O)c1cc2c(o1)cccc2)C(=O)OC

STK625467
Synonyms: 9- (3- chlorophenyl)- 3- (2- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc1c2CN(CO1)c1cccc(c1)Cl

STK625469
Synonyms: 3- [2- (4- ethylpiperazin- 1- yl)- 2- oxoethyl]quinazolin- 4(3H)- one
Smiles: CCN1CCN(CC1)C(=O)Cn1cnc2c(c1=O)cccc2

STK625472
Synonyms: ethyl{[6- ethyl- 3- (2- methyl- 1,3- thiazol- 4- yl)- 4- oxo- 4H- chromen- 7- yl]oxy}acetate
Smiles: CCOC(=O)COc1cc2occ(c(=O)c2cc1CC)c1csc(n1)C

STK625476
Synonyms: (5E)- 5- [(7- hydroxy- 2,3- dihydro[1,4]dioxino[2,3- g]quinolin- 8- yl)methylidene]- 2- (pyridin- 2- ylamino)- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1cc2cc3OCCOc3cc2nc1O)Nc1ccccn1

STK625478
Synonyms: 2- [5- hydroxy- 2- (4- methylpiperazin- 1- yl)- 4H- imidazol- 4- yl]- N- [3- (trifluoromethyl)phenyl]acetamide
Smiles: CN1CCN(CC1)C1=NC(C(=N1)O)CC(=O)Nc1cccc(c1)C(F)(F)F

STK625481
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)NCCCn1cncc1

STK625485
Synonyms: 2- hydroxy- 5- phenyl- 1- (2- phenylethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Oc1nc(=O)c2c(n1CCc1ccccc1)nccc2c1ccccc1

STK625489
Synonyms: [7- (2- methoxyphenyl)- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl](piperidin- 1- yl)methanone
Smiles: COc1ccccc1C1C(=C(C)N=c2n1nc[nH]2)C(=O)N1CCCCC1

STK625491
Synonyms: N- (3- bromophenyl)- 7H- purin- 6- amine
Smiles: Brc1cccc(c1)Nc1ncnc2c1[nH]cn2

STK625492
Synonyms: N- cyclopropyl- 2- {2- [(methylsulfonyl)amino]- 1,3- thiazol- 4- yl}acetamide
Smiles: O=C(Cc1csc(n1)NS(=O)(=O)C)NC1CC1

STK625494
Synonyms: [2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl](1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)methanone
Smiles: O=C(N1CC2(CC1CC(C2)(C)C)C)c1ccc2c(c1)sc(n2)n1cccc1

STK625495
Synonyms: 5- (3,4- dimethoxyphenyl)- 2- hydroxy- 1- methylpyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1OC)c1ccnc2c1c(=O)nc(n2C)O

STK625496
Synonyms: [1- amino- 5- (4- methylpiperidin- 1- yl)- 6,7,8,9- tetrahydrothieno[2,3- c]isoquinolin- 2- yl](piperidin- 1- yl)methanone
Smiles: CC1CCN(CC1)c1nc2sc(c(c2c2c1CCCC2)N)C(=O)N1CCCCC1

STK625497
Synonyms: 1- [2- (2- fluorophenyl)ethyl]- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)CCc1ccccc1F

STK625501
Synonyms: 2- benzyl- 7- (5- bromopyridin- 2- yl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Brc1ccc(nc1)n1c(C)c(c2c1ncn1c2nc(n1)Cc1ccccc1)C

STK625504
Synonyms: [4- (4- chlorophenyl)- 4- hydroxypiperidin- 1- yl](4- methyl- 2- phenyl- 1,3- thiazol- 5- yl)methanone
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)c1sc(nc1C)c1ccccc1

STK625506
Synonyms: (2Z)- 2- (4- bromobenzylidene)- 8- (pyridin- 4- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Brc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccncc1

STK625507
Synonyms: 4,6- dimethyl- 2H- chromen- 2- one
Smiles: Cc1ccc2c(c1)c(C)cc(=O)o2

STK625508
Synonyms: 1- methyl- 1- [(1- methyl- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- 3- phenylthiourea
Smiles: CN(C(=S)Nc1ccccc1)Cc1cc2ccccc2n(c1=O)C

STK625509
Synonyms: ethyl2- {[(2E)- 2- (3- hydroxyquinoxalin- 2(1H)- ylidene)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccccc1NC(=O)/C=c\1/[nH]c2ccccc2nc1O

STK856700
Synonyms: 4- (7- methoxy- 1- benzofuran- 2- yl)- 2- oxo- 2H- chromen- 6- ylthiophene- 2- carboxylate
Smiles: COc1cccc2c1oc(c2)c1cc(=O)oc2c1cc(cc2)OC(=O)c1cccs1

STK625511
Synonyms: ethyl[(2Z)- 2- [(cyclopropylcarbonyl)imino]- 4- (4- fluorophenyl)- 2,3- dihydro- 1,3- thiazol- 5- yl]carbamate
Smiles: CCOC(=O)Nc1s/c(=N\C(=O)C2CC2)/[nH]c1c1ccc(cc1)F

STK625512
Synonyms: N- [1- (1H- indol- 3- yl)propan- 2- yl]- 7- methoxy- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)NC(Cc1c[nH]c2c1cccc2)C

STK625514
Synonyms: 6- (3,4- dimethoxyphenyl)- 2- (4- methylpiperazin- 1- yl)pyrimidin- 4- ol
Smiles: COc1cc(ccc1OC)c1cc(O)nc(n1)N1CCN(CC1)C

STK625518
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- methoxybenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OC(=O)c1ccccc1OC)cn2CC

STK625524
Synonyms: propan- 2- yl{[4- (7- methoxy- 1- benzofuran- 2- yl)- 2- oxo- 7- phenyl- 2H- chromen- 6- yl]oxy}acetate
Smiles: COc1cccc2c1oc(c2)c1cc(=O)oc2c1cc(OCC(=O)OC(C)C)c(c2)c1ccccc1

STK625525
Synonyms: 2- hydroxy- N- [(5E)- 4- oxo- 5- (quinoxalin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: S=C1S/C(=C/c2ccc3c(c2)nccn3)/C(=O)N1NC(=O)c1ccccc1O

STK625527
Synonyms: N- [2- (5- amino- 1- methyl- 1H- benzimidazol- 2- yl)ethyl]- 3- chloro- 4- fluorobenzamide
Smiles: Nc1ccc2c(c1)nc(n2C)CCNC(=O)c1ccc(c(c1)Cl)F

STK625530
Synonyms: N,N- diethyl- 2- [(5- hydroxy- 4- oxo- 2- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: CCN(C(=O)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1)CC

STK625532
Synonyms: N- [(4- hydroxyphthalazin- 1- yl)acetyl]methionine
Smiles: CSCCC(C(=O)O)NC(=O)Cc1nnc(c2c1cccc2)O

STK625536
Synonyms: 2- (1H- indol- 3- yl)- 1- [3- (thiomorpholin- 4- ylcarbonyl)piperidin- 1- yl]ethanone
Smiles: O=C(N1CCCC(C1)C(=O)N1CCSCC1)Cc1c[nH]c2c1cccc2

STK856701
Synonyms: (5E)- 2- hydroxy- 1- (4- methylphenyl)- 5- {[5- (piperidin- 1- yl)furan- 2- yl]methylidene}pyrimidine- 4,6(1H,5H)- dione
Smiles: Cc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(o2)N2CCCCC2)/C1=O)O

STK625541
Synonyms: 1- [(2Z)- 6- methoxy- 4- methylquinazolin- 2(1H)- ylidene]guanidine
Smiles: COc1ccc2c(c1)c(C)n/c(=N\C(=N)N)/[nH]2

STK625543
Synonyms: ethyl2- (2,3- dihydro- 1H- indol- 1- yl)- 4- hydroxypyrimidine- 5- carboxylate
Smiles: CCOC(=O)c1cnc(nc1O)N1CCc2c1cccc2

STK625545
Synonyms: 8,9- dimethyl- 7- (pyridin- 2- ylmethyl)- 2- (thiophen- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1c(C)n(c2c1c1nc(nn1cn2)c1cccs1)Cc1ccccn1

STK625546
Synonyms: N- (cyanomethyl)- 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)acetamide
Smiles: N#CCNC(=O)Cn1c(O)nc2c(c1=O)cccc2

STK625547
Synonyms: N~2~- (2- chloro- 7H- purin- 6- yl)- N- (6- methylheptan- 2- yl)glycinamide
Smiles: CC(CCCC(NC(=O)CNc1nc(Cl)nc2c1[nH]cn2)C)C

STK625548
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- (2,2,6,6- tetramethylpiperidin- 4- yl)- beta- alaninamide
Smiles: O=C(NC1CC(C)(C)NC(C1)(C)C)CCNc1nc(Cl)nc2c1[nH]cn2

STK625554
Synonyms: methyl3- amino- 6- (pyridin- 2- yl)thieno[2,3- b]pyridine- 2- carboxylate
Smiles: COC(=O)c1sc2c(c1N)ccc(n2)c1ccccn1

STK625555
Synonyms: 5- (5- chloro- 2- hydroxyphenyl)- 4- (quinolin- 5- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(c(c1)c1n[nH]c(=S)n1c1cccc2c1cccn2)O

STK625558
Synonyms: 3- (4- chlorophenyl)- 2- methyl- 7- {2- oxo- 2- [4- (pyrimidin- 2- yl)piperazin- 1- yl]ethoxy}- 4H- chromen- 4- one
Smiles: Clc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)N1CCN(CC1)c1ncccn1

STK856703
Synonyms: 3- (2- methoxyphenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl4- chlorobenzoate
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc(c2)OC(=O)c1ccc(cc1)Cl

STK625562
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 4- [(5Z)- 5- (3- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]butanamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)CCCN1C(=S)S/C(=C\c2cccc(c2)F)/C1=O

STK625563
Synonyms: 6- {[(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}- 2- [(4,6,8- trimethylquinazolin- 2- yl)amino]pyrimidin- 4- ol
Smiles: Oc1nc(nc(c1)CSc1nnc(s1)C)Nc1nc(C)c2c(n1)c(C)cc(c2)C

STK856704
Synonyms: N- {2- [(4- methoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 6- yl}acetamide
Smiles: COc1ccc(cc1)C(=O)c1oc2c(c1C)ccc(c2)NC(=O)C

STK625569
Synonyms: 4- ({4- [(E)- (4- hydroxy- 1- methyl- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)methyl]- 2- methoxyphenoxy}methyl)benzoicacid
Smiles: COc1cc(ccc1OCc1ccc(cc1)C(=O)O)/C=C/1\C(=NC(=O)N(C1=O)C)O

STK625570
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- (6- methylheptan- 2- yl)piperidine- 3- carboxamide
Smiles: CC(CCCC(NC(=O)C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)C)C

STK856705
Synonyms: (2Z)- 3- oxo- 2- (2,4,5- trimethoxybenzylidene)- 2,3- dihydro- 1- benzofuran- 6- yl4- methoxybenzenesulfonate
Smiles: COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cc(OC)c(cc1OC)OC)/C2=O

STK625573
Synonyms: methyl[(2E)- 2- {[(6- chloro- 7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- yl]acetate
Smiles: Cc1c(CC(=O)/N=c\2/scc([nH]2)CC(=O)OC)c(=O)oc2c1cc(Cl)c(c2)O

STK625574
Synonyms: 3- (5- hydroxy- 3- propyl- 1H- pyrazol- 4- yl)- 6,7- dimethoxy- 2- benzofuran- 1(3H)- one
Smiles: CCCc1n[nH]c(c1C1OC(=O)c2c1ccc(c2OC)OC)O

STK625577
Synonyms: 4- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- (pyrimidin- 2- yl)benzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)Nc2ncccn2)S(=O)(=O)CC1(C)C

STK856706
Synonyms: 6- [4- (3- chlorophenyl)piperazin- 1- yl]- 7H- purine
Smiles: Clc1cccc(c1)N1CCN(CC1)c1ncnc2c1[nH]cn2

STK625578
Synonyms: N- (3- chlorophenyl)- 2- [2- (4- methylpiperazin- 1- yl)ethyl]piperidine- 1- carboxamide
Smiles: CN1CCN(CC1)CCC1CCCCN1C(=O)Nc1cccc(c1)Cl

STK625582
Synonyms: 6- {[4- (2,3- dihydro- 1,4- benzodioxin- 2- ylcarbonyl)piperazin- 1- yl]carbonyl}- 2- phenyl- 4,5- dihydropyridazin- 3(2H)- one
Smiles: O=C(C1COc2c(O1)cccc2)N1CCN(CC1)C(=O)C1=NN(C(=O)CC1)c1ccccc1

STK625583
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- (4- hydroxyphthalazin- 1- yl)acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC1CCS(=O)(=O)C1

STK625584
Synonyms: 2- [3- (pyridin- 4- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: n1ccc(cc1)c1nnc2n1nc(s2)c1cc2c([nH]1)cccc2

STK625585
Synonyms: 4,4- dimethyl- 2- [4- (pyrrolidin- 1- ylsulfonyl)phenyl]- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)N2CCCC2)S(=O)(=O)CC1(C)C

STK625586
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- 1H- indole- 3- carboxamide
Smiles: O=C(c1c[nH]c2c1cccc2)NCCCn1cncc1

STK625587
Synonyms: 7- butoxy- 4- methyl- 3- propyl- 2H- chromen- 2- one
Smiles: CCCCOc1ccc2c(c1)oc(=O)c(c2C)CCC

STK625588
Synonyms: 5- methyl- 2- [(3- methylbutyl)sulfanyl][1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CC(CCSc1nn2c(n1)nc(cc2O)C)C

STK856707
Synonyms: (2E)- 2- (furan- 2- ylmethylidene)- 8- [2- (thiophen- 2- yl)ethyl]- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C\c2ccco2)/Oc2c1ccc1c2CN(CO1)CCc1cccs1

STK625590
Synonyms: 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 1- [4- (furan- 2- yl)butan- 2- yl]- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CC(N1CC(=C(C1=N)c1sc(c(n1)C)C)O)CCc1ccco1

STK625592
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl3,5- dimethoxybenzoate
Smiles: COc1cc(OC)cc(c1)C(=O)Oc1ccc2c(c1C)O/C(=C/c1cn(c3c1cccc3)CC)/C2=O

STK625593
Synonyms: 3- (4- methoxyphenyl)- 2- methyl- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc1c2CN(CO1)Cc1ccncc1

STK625594
Synonyms: (2Z)- 2- (2- chlorobenzylidene)- 8- (pyridin- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccccc2Cl)/Oc2c1ccc1c2CN(CO1)Cc1ccccn1

STK625595
Synonyms: 4- (methylsulfanyl)- 2- [(5E)- 4- oxo- 5- (quinoxalin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C/c2ccc3c(c2)nccn3)/C1=O)C(=O)O

STK625596
Synonyms: 2- {4- [(E)- (2,6- dihydroxy- 4- oxopyrimidin- 5(4H)- ylidene)methyl]phenoxy}propanoicacid
Smiles: OC1=NC(=O)/C(=C/c2ccc(cc2)OC(C(=O)O)C)/C(=N1)O

STK625597
Synonyms: 5- bromo- N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 1- benzofuran- 2- carboxamide
Smiles: Brc1ccc2c(c1)cc(o2)C(=O)NCCc1c[nH]c2c1cc(F)cc2

STK625599
Synonyms: {1- [(4- methoxyphenyl)sulfonyl]piperidin- 4- yl}[4- (pyrimidin- 2- yl)piperazin- 1- yl]methanone
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CCN(CC1)c1ncccn1

STK625600
Synonyms: 3- methyl- 1- propyl- 1H- pyrazole- 5- carbohydrazide
Smiles: Cc1cc(n(n1)CCC)C(=O)NN

STK625601
Synonyms: N- (pyridin- 3- ylmethyl)- N~3~- pyrimidin- 2- yl- beta- alaninamide
Smiles: O=C(NCc1cccnc1)CCNc1ncccn1

STK625606
Synonyms: (2Z)- 2- (pyridin- 4- ylmethylidene)- 8- (thiophen- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccncc2)/Oc2c1ccc1c2CN(CO1)Cc1cccs1

STK625610
Synonyms: 2- chloro- 6- oxo- 4- [(pyridin- 2- ylammonio)methyl]- 7,8,9,10- tetrahydro- 6H- benzo[c]chromen- 3- olate
Smiles: Clc1cc2c(c(c1[O-])C[NH2+]c1ccccn1)oc(=O)c1c2CCCC1

STK625615
Synonyms: N- [3- (acetylamino)phenyl]- 2- (trifluoromethyl)- 1H- benzimidazole- 5- carboxamide
Smiles: CC(=O)Nc1cccc(c1)NC(=O)c1ccc2c(c1)nc([nH]2)C(F)(F)F

STK625618
Synonyms: N- 1,3- benzodioxol- 5- yl- N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]alaninamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)Nc1ccc2c(c1)OCO2)C

STK625630
Synonyms: N- cycloheptyl- 1- (1H- indol- 3- ylacetyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)Cc1c[nH]c2c1cccc2)NC1CCCCCC1

STK625631
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2)NCCc1c[nH]c2c1cc(F)cc2

STK625634
Synonyms: 2- (7- methoxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)- N- (3- methyl- 1- phenyl- 1H- pyrazol- 5- yl)acetamide
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)Nc1cc(nn1c1ccccc1)C

STK625641
Synonyms: ethyl5- {[(2E)- 4- ethoxy- 4- oxobut- 2- en- 1- yl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)/C=C/COc1ccc2c(c1)c(C(=O)OCC)c(o2)C

STK856713
Synonyms: (2Z)- 2- (3- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylmethanesulfonate
Smiles: Brc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)C

STK625643
Synonyms: 2- [2- (3- methoxyphenyl)- 1,3- thiazol- 4- yl]- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]acetamide
Smiles: COc1cccc(c1)c1scc(n1)CC(=O)Nc1ccc(cc1)Cn1cncn1

STK625645
Synonyms: 2- (2- chlorophenyl)- 4- methyl- 6- {[2- oxo- 2- (pyrrolidin- 1- yl)ethyl]sulfanyl}pyrimidine- 5- carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCCC2)nc(nc1C)c1ccccc1Cl

STK856714
Synonyms: ethyl2- {[(2Z)- 2- (3- chlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}propanoate
Smiles: CCOC(=O)C(Oc1ccc2c(c1)O/C(=C\c1cccc(c1)Cl)/C2=O)C

STK625648
Synonyms: 1- amino- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)N

STK625653
Synonyms: 4- (1H- indol- 2- ylcarbonyl)- N- [(2S)- 1- oxo- 1- (propan- 2- ylamino)propan- 2- yl]piperazine- 1- carboxamide
Smiles: CC(NC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C)C

STK625654
Synonyms: N- [4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]- 3,5- dimethoxybenzamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)c1cc(OC)cc(c1)OC

STK625660
Synonyms: 4- hydroxy- 1,7- dimethyl- 8- {3- [(4- phenoxyphenyl)amino]propyl}- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Oc1nc(=O)n(c2c1n1cc(n(c1n2)CCCNc1ccc(cc1)Oc1ccccc1)C)C

STK625665
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- methylbenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)c1ccccc1C)cn2CC

STK625667
Synonyms: N- (3- chlorophenyl)- 1- (1H- indol- 6- ylcarbonyl)piperidine- 3- carboxamide
Smiles: Clc1cccc(c1)NC(=O)C1CCCN(C1)C(=O)c1ccc2c(c1)[nH]cc2

STK625670
Synonyms: (5E)- 5- {[2,5- dimethyl- 1- (pyridin- 3- yl)- 1H- pyrrol- 3- yl]methylidene}- 2,6- dihydroxypyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C/c2cc(n(c2C)c2cccnc2)C)/C(=N1)O

STK625675
Synonyms: N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]furan- 2- carboxamide
Smiles: O=C(c1ccco1)Nc1ccc(cc1)Cn1cncn1

STK625678
Synonyms: (2Z)- 2- [(5- bromo- 1- benzofuran- 2- yl)methylidene]- 7- [(4- ethylpiperazin- 1- ium- 1- yl)methyl]- 4- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CCN1CC[NH+](CC1)Cc1c([O-])cc(c2c1O/C(=C\c1cc3c(o1)ccc(c3)Br)/C2=O)C

STK625679
Synonyms: ethyl1- (2- chloro- 7H- purin- 6- yl)piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2

STK625681
Synonyms: N- (4- {[4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]sulfamoyl}phenyl)acetamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NS(=O)(=O)c1ccc(cc1)NC(=O)C

STK625682
Synonyms: N- (4,6- dimethyl- 1H- pyrazolo[3,4- b]pyridin- 3- yl)- N'- (3- methoxypropyl)ethanediamide
Smiles: COCCCNC(=O)C(=O)Nc1n[nH]c2c1c(C)cc(n2)C

STK625683
Synonyms: 4- hydroxy- 1,6,7- trimethyl- 8- {2- [(4- phenoxyphenyl)amino]ethyl}- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Oc1nc(=O)n(c2c1n1c(n2)n(c(c1C)C)CCNc1ccc(cc1)Oc1ccccc1)C

STK625686
Synonyms: N- [2- (azepan- 1- ylsulfonyl)ethyl]- 2,2- dimethyl- N- (pyridin- 2- ylmethyl)propanamide
Smiles: O=C(C(C)(C)C)N(Cc1ccccn1)CCS(=O)(=O)N1CCCCCC1

STK856716
Synonyms: 3,4,8- trimethyl- 2- oxo- 2H- chromen- 7- ylpropanoate
Smiles: CCC(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)C

STK625689
Synonyms: N- (1,3- benzodioxol- 5- ylmethyl)- 2- (4- hydroxyphthalazin- 1- yl)acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCc1ccc2c(c1)OCO2

STK625691
Synonyms: 2- [4- (diphenylmethyl)piperazin- 1- yl]- 6- methyl- 5- propylpyrimidin- 4- ol
Smiles: CCCc1c(C)nc(nc1O)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK625692
Synonyms: 2- {4- [6- hydroxy- 3- methyl- 1- (2- methylphenyl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 4- yl]phenoxy}acetamide
Smiles: NC(=O)COc1ccc(cc1)C1CC(=Nc2c1c(C)nn2c1ccccc1C)O

STK625693
Synonyms: ethyl2- (4- methylpiperazin- 1- yl)- 6- oxo- 4- (2,3,4- trimethoxyphenyl)- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccc(c(c1OC)OC)OC)N1CCN(CC1)C

STK625699
Synonyms: N- [2- (dimethylamino)ethyl]- N'- (quinolin- 5- yl)ethanediamide
Smiles: CN(CCNC(=O)C(=O)Nc1cccc2c1cccn2)C

STK625701
Synonyms: 1- (4- chlorophenyl)- 3- (3- cyano- 7,7- dimethyl- 7,8- dihydro- 5H- pyrano[4,3- b]pyridin- 2- yl)urea
Smiles: N#Cc1cc2COC(Cc2nc1NC(=O)Nc1ccc(cc1)Cl)(C)C

STK625702
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (2- methoxyphenyl)propanamide
Smiles: COc1ccccc1NC(=O)CCSc1nc(Cl)nc2c1[nH]cn2

STK625703
Synonyms: 5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- methoxy- N- (2,4,6- trimethylphenyl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1c(C)cc(cc1C)C)N1C(=O)C(CS1(=O)=O)(C)C

STK625706
Synonyms: 5- {[(4- methylpyrimidin- 2- yl)sulfanyl]methyl}- 2- (methylsulfanyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CSc1nn2c(n1)nc(cc2O)CSc1nccc(n1)C

STK625709
Synonyms: (5E)- 5- [(6- methoxyquinolin- 2- yl)methylidene]- 3- [3- (morpholin- 4- yl)propyl]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccc2c(c1)ccc(n2)/C=C\1/SC(=S)N(C1=O)CCCN1CCOCC1

STK625711
Synonyms: (1Z)- N- {[8,9- dimethyl- 7- (2- methylpropyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (4- methoxyphenyl)ethanimine
Smiles: COc1ccc(cc1)/C(=N\OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)CC(C)C)/C

STK625712
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (3- methoxyphenyl)- N- methyl- 1,3- oxazol- 5- amine
Smiles: CNc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1cccc(c1)OC

STK625714
Synonyms: [2- (1H- benzimidazol- 2- yl)pyrrolidin- 1- yl](1- benzofuran- 2- yl)methanone
Smiles: O=C(N1CCCC1c1nc2c([nH]1)cccc2)c1cc2c(o1)cccc2

STK625715
Synonyms: 3- (4- methoxyphenyl)- 2- methyl- 9- (thiophen- 2- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc1c2CN(CO1)Cc1cccs1

STK856718
Synonyms: (2Z)- 2- benzylidene- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldiethylcarbamate
Smiles: CCN(C(=O)Oc1ccc2c(c1)O/C(=C\c1ccccc1)/C2=O)CC

STK625725
Synonyms: N- {2- [2- oxo- 6- (propan- 2- yl)- 2H- chromen- 4- yl]- 1- benzofuran- 3- yl}cyclohexanecarboxamide
Smiles: O=c1oc2ccc(cc2c(c1)c1oc2c(c1NC(=O)C1CCCCC1)cccc2)C(C)C

STK625726
Synonyms: 5- (3,4- dimethoxyphenyl)- 2- hydroxy- 1- (tetrahydrofuran- 2- ylmethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COc1cc(ccc1OC)c1ccnc2c1c(=O)nc(n2CC1CCCO1)O

STK625727
Synonyms: 3- [2- (3,4- dimethoxyphenyl)ethyl]- 5,6- dimethyl- 7- (6- methylpyridin- 2- yl)- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: COc1cc(ccc1OC)CCn1cnc2c(c1=N)c(C)c(n2c1cccc(n1)C)C

STK625731
Synonyms: 2,2- dimethyl- N- (pyridin- 2- ylmethyl)- N- [2- (pyrrolidin- 1- ylsulfonyl)ethyl]propanamide
Smiles: O=C(C(C)(C)C)N(Cc1ccccn1)CCS(=O)(=O)N1CCCC1

STK625734
Synonyms: 2- [3- (4- chlorobenzyl)- 2- hydroxy- 4- oxo- 1,3,8- triazaspiro[4.5]dec- 1- en- 8- yl]- N- (3,4- dimethoxyphenyl)acetamide
Smiles: COc1cc(ccc1OC)NC(=O)CN1CCC2(CC1)N=C(N(C2=O)Cc1ccc(cc1)Cl)O

STK625738
Synonyms: 2- {[3- (4- chlorophenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (4- hydroxyphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)O)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK856720
Synonyms: 3- [(Z)- (6- methoxy- 3- oxo- 1- benzofuran- 2(3H)- ylidene)methyl]phenylmethanesulfonate
Smiles: COc1ccc2c(c1)O/C(=C\c1cccc(c1)OS(=O)(=O)C)/C2=O

STK625742
Synonyms: (E)- 1- (4- chlorophenyl)- N- {[8,9- dimethyl- 7- (4- methylpyridin- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}methanimine
Smiles: Clc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1nccc(c1)C

STK625743
Synonyms: N- {2- oxo- 2- [({trans- 4- [(4- phenylpiperazin- 1- yl)carbonyl]cyclohexyl}methyl)amino]ethyl}benzamide
Smiles: O=C(CNC(=O)c1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)N1CCN(CC1)c1ccccc1

STK625746
Synonyms: 5- imino- 1- (3- iodophenyl)- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Ic1cccc(c1)N1CC(=C(C1=N)c1scc(n1)C)O

STK625747
Synonyms: methyl3- {[2- (dimethylamino)- 3,5,6- trifluoropyridin- 4- yl]oxy}benzoate
Smiles: COC(=O)c1cccc(c1)Oc1c(F)c(F)nc(c1F)N(C)C

STK856721
Synonyms: (2Z)- 2- (4- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylmethanesulfonate
Smiles: Brc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)C

STK625749
Synonyms: 7- methoxy- 3- [(E)- (3- methyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]quinolin- 2(1H)- one
Smiles: COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C\1/SC(=S)N(C1=O)C

STK625751
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- [(1- ethylpyrrolidin- 2- yl)methyl]- beta- alaninamide
Smiles: CCN1CCCC1CNC(=O)CCNc1nc(Cl)nc2c1[nH]cn2

STK625752
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- (pyridin- 3- ylmethyl)- beta- alaninamide
Smiles: O=C(NCc1cccnc1)CCNc1nc(Cl)nc2c1[nH]cn2

STK625753
Synonyms: 2- amino- 4- (4- chlorophenyl)- 7- hydroxy[1,3]thiazolo[4,5- d]pyrimidin- 5(4H)- one
Smiles: Clc1ccc(cc1)n1c(=O)nc(c2c1nc(s2)N)O

STK625754
Synonyms: 5- (biphenyl- 4- yl)- 2- hydroxypyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Oc1nc(=O)c2c([nH]1)nccc2c1ccc(cc1)c1ccccc1

STK625756
Synonyms: (5E)- 3- (3- methoxyphenyl)- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1cccc(c1)N1C(=S)S/C(=C/c2cnc3c(n2)cccc3)/C1=O

STK625761
Synonyms: N- [(4- hydroxyphthalazin- 1- yl)acetyl]threonine
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)O)C(O)C

STK625765
Synonyms: 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)- N- (pyridin- 3- ylmethyl)acetamide
Smiles: O=C(Cc1nn2c(n1)nc(cc2O)C)NCc1cccnc1

STK625769
Synonyms: 3- (4- bromophenyl)- 4- oxo- 4H- chromen- 7- yl3,4,5- trimethoxybenzoate
Smiles: COc1cc(cc(c1OC)OC)C(=O)Oc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Br

STK625775
Synonyms: (E)- N- {[8,9- dimethyl- 7- (pyridin- 4- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (2- methoxyphenyl)methanimine
Smiles: COc1ccccc1/C=N/OCc1nc2n(n1)cnc1c2c(C)c(n1Cc1ccncc1)C

STK625776
Synonyms: 2- amino- 7- [(2- chlorobenzyl)oxy]- 3- (4- methoxyphenyl)- 4H- chromen- 4- one
Smiles: COc1ccc(cc1)c1c(N)oc2c(c1=O)ccc(c2)OCc1ccccc1Cl

STK856723
Synonyms: 3- (3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yl)- 4- oxo- 4H- chromen- 7- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)occ(c2=O)c1ccc2c(c1)OCCCO2

STK625783
Synonyms: ethyl4- {[(7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)acetyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)Cc1nn2c(n1)nc(cc2O)C

STK856725
Synonyms: (2Z)- 8- (2- chlorobenzyl)- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc1c2CN(CO1)Cc1ccccc1Cl

STK625784
Synonyms: 5- bromo- N- (pyridin- 2- ylmethyl)- 1- benzofuran- 2- carboxamide
Smiles: Brc1ccc2c(c1)cc(o2)C(=O)NCc1ccccn1

STK625786
Synonyms: 8- {2- [(2,4- dimethoxyphenyl)amino]ethyl}- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: COc1cc(OC)ccc1NCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK625787
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (3- methoxyphenyl)propanamide
Smiles: COc1cccc(c1)NC(=O)CCSc1nc(Cl)nc2c1[nH]cn2

STK625793
Synonyms: (2Z)- 6- {[(2E)- 3- phenylprop- 2- en- 1- yl]oxy}- 2- (2,4,5- trimethoxybenzylidene)- 1- benzofuran- 3(2H)- one
Smiles: COc1cc(OC)c(cc1/C=C/1\Oc2c(C1=O)ccc(c2)OC/C=C/c1ccccc1)OC

STK625794
Synonyms: 2- hydroxy- 1- (2- methoxyethyl)- 5- (naphthalen- 1- yl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCCn1c(O)nc(=O)c2c1nccc2c1cccc2c1cccc2

STK856726
Synonyms: 9- (4- fluorophenyl)- 3- (2- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc1c2CN(CO1)c1ccc(cc1)F

STK625795
Synonyms: ethyl{2- [4- (diphenylmethyl)piperazin- 1- yl]- 6- hydroxypyrimidin- 4- yl}acetate
Smiles: CCOC(=O)Cc1cc(O)nc(n1)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK625798
Synonyms: N- (4- chlorophenyl)- 4- [2- (pyridin- 4- yl)ethyl]- 1,4- diazepane- 1- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)N1CCCN(CC1)CCc1ccncc1

STK625801
Synonyms: N- methyl- 4- [2- (morpholin- 4- yl)- 2- oxoethyl]piperazine- 1- carbothioamide
Smiles: CNC(=S)N1CCN(CC1)CC(=O)N1CCOCC1

STK625803
Synonyms: 2- {(1E)- 5- fluoro- 2- methyl- 1- [4- (methylsulfinyl)benzylidene]- 1H- inden- 3- yl}- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(CC1=C(C)/C(=C\c2ccc(cc2)S(=O)C)/c2c1cc(F)cc2)NCc1ccncc1

STK625804
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- N'- (pyridin- 4- yl)ethanediamide
Smiles: O=C(C(=O)NCCCn1cncc1)Nc1ccncc1

STK625807
Synonyms: 2- [2- (morpholin- 4- yl)ethyl]- N- phenylpiperidine- 1- carboxamide
Smiles: O=C(N1CCCCC1CCN1CCOCC1)Nc1ccccc1

STK625809
Synonyms: 7- hydroxy- 8- [(4- methoxyphenyl)(morpholin- 4- yl)methyl]- 4- methyl- 2H- benzo[h]chromen- 2- one
Smiles: COc1ccc(cc1)C(c1ccc2c(c1O)ccc1c2oc(=O)cc1C)N1CCOCC1

STK625812
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 3- methyl- 4- oxo- 2- phenyl- 4H- chromene- 8- carboxamide
Smiles: O=C(c1cccc2c1oc(c1ccccc1)c(c2=O)C)NC1C=CS(=O)(=O)C1

STK625817
Synonyms: [7- (4- hydroxyphenyl)- 2,5- dimethyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl](morpholin- 4- yl)methanone
Smiles: O=C(C1=C(C)N=c2n(C1c1ccc(cc1)O)nc([nH]2)C)N1CCOCC1

STK625818
Synonyms: methyl[2- ethyl- 7- hydroxy- 3- (4- methoxyphenyl)- 5- methylpyrazolo[1,5- a]pyrimidin- 6- yl]acetate
Smiles: COC(=O)Cc1c(C)nc2n(c1O)nc(c2c1ccc(cc1)OC)CC

STK625822
Synonyms: 3- (4- chlorophenyl)- 2- ethyl- 5- methyl- 6- (prop- 2- en- 1- yl)pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: C=CCc1c(C)nc2n(c1O)nc(c2c1ccc(cc1)Cl)CC

STK625823
Synonyms: 3- (furan- 2- ylmethyl)- 5,6- dimethyl- 7- (pyridin- 2- ylmethyl)- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: Cc1c(C)n(c2c1c(=N)n(cn2)Cc1ccco1)Cc1ccccn1

STK625824
Synonyms: trans- N- {(2S)- 1- oxo- 1- [(pyridin- 2- ylmethyl)amino]propan- 2- yl}- 4- {[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C([C@@H](NC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1)C)NCc1ccccn1

STK625826
Synonyms: [4- (4- methoxyphenyl)piperazin- 1- yl][1- (5- nitropyridin- 2- yl)piperidin- 3- yl]methanone
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-]

STK625827
Synonyms: N- phenyl- 4- [2- (pyridin- 4- yl)ethyl]- 1,4- diazepane- 1- carboxamide
Smiles: O=C(N1CCCN(CC1)CCc1ccncc1)Nc1ccccc1

STK625828
Synonyms: 7- (3- methoxyphenyl)- 2,8,9- trimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cccc(c1)n1c(C)c(c2c1ncn1c2nc(n1)C)C

STK625831
Synonyms: 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- (pyridin- 2- yl)butanamide
Smiles: CCC(n1c(O)nc2c(c1=O)cccc2)C(=O)Nc1ccccn1

STK625834
Synonyms: 4- [(methylamino)methyl]quinolin- 2(1H)- one
Smiles: CNCc1cc(=O)[nH]c2c1cccc2

STK625835
Synonyms: N- (4- ethoxyphenyl)- N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]acetamide
Smiles: CCOc1ccc(cc1)N(C(=O)C)Cc1cc2cc(OC)ccc2[nH]c1=O

STK625837
Synonyms: 2- methyl- 3- (morpholin- 4- ylcarbonyl)- 1,1- dioxido- 2H- 1,2- benzothiazin- 4- ylpyridine- 2- carboxylate
Smiles: O=C(c1ccccn1)OC1=C(C(=O)N2CCOCC2)N(C)S(=O)(=O)c2c1cccc2

STK625838
Synonyms: 1- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2sc(c(n2)C)C)C(=N)N(C1)c1ccc2c(c1)OCCO2

STK625839
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 6- [(4- methoxybenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc(cc1)COc1ccc2c(c1)O/C(=C/c1cn(c3c1cc(OC)cc3)CC)/C2=O

STK625843
Synonyms: methyl4- [(2,4- dimethoxyphenyl)carbamoyl]- 6- hydroxy- 2- methyl- 4,5- dihydropyridine- 3- carboxylate
Smiles: COc1ccc(c(c1)OC)NC(=O)C1CC(=NC(=C1C(=O)OC)C)O

STK625847
Synonyms: 1- [(3- methyl- 4- oxo- 2- phenyl- 4H- chromen- 8- yl)carbonyl]piperidin- 4- one
Smiles: O=C1CCN(CC1)C(=O)c1cccc2c1oc(c1ccccc1)c(c2=O)C

STK625849
Synonyms: N- {[4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]carbonyl}- L- valine
Smiles: CC([C@@H](C(=O)O)NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C

STK625850
Synonyms: ethyl7- cyano- 3- (furan- 2- ylmethyl)- 6- thioxo- 1,3,4,6- tetrahydro- 2H- pyrido[1,2- a][1,3,5]triazine- 9- carboxylate
Smiles: CCOC(=O)c1cc(C#N)c(=S)n2c1NCN(C2)Cc1ccco1

STK856728
Synonyms: 6- benzyl- 3- (propylsulfanyl)- 1,2,4- triazin- 5- ol
Smiles: CCCSc1nnc(c(n1)O)Cc1ccccc1

STK625852
Synonyms: {2- [2- (3,4- dihydroquinolin- 1(2H)- yl)- 2- oxoethoxy]phenyl}phosphonicacid
Smiles: O=C(N1CCCc2c1cccc2)COc1ccccc1P(=O)(O)O

STK625853
Synonyms: 3- hydroxy- N- {1- [(3- methoxypropyl)amino]- 1- oxo- 3- phenylpropan- 2- yl}quinoxaline- 1(2H)- carboxamide
Smiles: COCCCNC(=O)C(NC(=O)N1CC(=Nc2c1cccc2)O)Cc1ccccc1

STK625857
Synonyms: 2- methyl- 3- (2- phenylethyl)pyrimido[1,2- a]benzimidazol- 4- ol
Smiles: Cc1nc2nc3c(n2c(c1CCc1ccccc1)O)cccc3

STK625858
Synonyms: N- {4- [(3E)- 3- (3,4- dihydroxybenzylidene)- 2,5- dioxopyrrolidin- 1- yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1C(=O)C/C(=C\c2ccc(c(c2)O)O)/C1=O

STK625859
Synonyms: 2- [1- (3- phenoxypropyl)piperidin- 4- yl]- 1,3- benzothiazole
Smiles: c1ccc(cc1)OCCCN1CCC(CC1)c1nc2c(s1)cccc2

STK625862
Synonyms: 7- [2- (dimethylamino)ethyl]- 5,6- dimethyl- N- (pyridin- 2- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: CN(CCn1c(C)c(c2c1ncnc2NCc1ccccn1)C)C

STK856731
Synonyms: ethyl4- [(2- carbamoylphenyl)amino]- 7- (trifluoromethyl)quinoline- 3- carboxylate
Smiles: CCOC(=O)c1cnc2c(c1Nc1ccccc1C(=O)N)ccc(c2)C(F)(F)F

STK625866
Synonyms: 3- methoxy- N- [2- (morpholin- 4- ylsulfonyl)ethyl]- N- (pyridin- 2- ylmethyl)benzamide
Smiles: COc1cccc(c1)C(=O)N(Cc1ccccn1)CCS(=O)(=O)N1CCOCC1

STK625869
Synonyms: methyl{(2Z)- 2- [(3- methylbutanoyl)imino]- 4- phenyl- 2,3- dihydro- 1,3- thiazol- 5- yl}carbamate
Smiles: COC(=O)Nc1s/c(=N\C(=O)CC(C)C)/[nH]c1c1ccccc1

STK625870
Synonyms: 7- (2- chlorophenyl)- 9- (trifluoromethyl)thieno[2,3- b:4,5- b']dipyridine- 2,4- diol
Smiles: Oc1cc(O)c2c(n1)c1c(s2)nc(cc1C(F)(F)F)c1ccccc1Cl

STK856732
Synonyms: 2- ({[1- (3,4- dichlorophenyl)- 1H- tetrazol- 5- yl]methyl}sulfanyl)- 1H- benzimidazole
Smiles: Clc1ccc(cc1Cl)n1nnnc1CSc1nc2c([nH]1)cccc2

STK625877
Synonyms: 2- phenyl- 9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- ol
Smiles: Oc1nc2sc3c(c2c2n1nc(n2)c1ccccc1)CCC3

STK625878
Synonyms: 2- [(5- hydroxy- 4- oxo- 2- phenyl- 4H- chromen- 7- yl)oxy]- N- (4- methylpiperazin- 1- yl)acetamide
Smiles: CN1CCN(CC1)NC(=O)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1

STK625888
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 1- (pyrimidin- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncccn1)NCCc1c[nH]c2c1cc(Cl)cc2

STK625890
Synonyms: N- (4- hydroxy- 6- methylpyrimidin- 2- yl)- 4- (4- methoxyphenyl)piperazine- 1- carboximidamide
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=N)Nc1nc(C)cc(n1)O

STK625893
Synonyms: N- (2,2- dimethoxyethyl)- 1- (pyrimidin- 2- yl)piperidine- 3- carboxamide
Smiles: COC(CNC(=O)C1CCCN(C1)c1ncccn1)OC

STK625894
Synonyms: N- [3- methyl- 2- (phenylcarbonyl)- 1- benzofuran- 6- yl]- 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)oc(c2C)C(=O)c1ccccc1)CCn1nnc2c(c1=O)cccc2

STK625895
Synonyms: 2- ethyl- N- [4- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2,5- oxadiazol- 3- yl]butanamide
Smiles: CCC(C(=O)Nc1nonc1c1ccc2c(c1)CCCC2)CC

STK856736
Synonyms: ethyl4- ({[5- chloro- 2- (methylsulfanyl)pyrimidin- 4- yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)c1nc(SC)ncc1Cl

STK856737
Synonyms: N- {2- [(4- methoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 5- yl}pyridine- 4- carboxamide
Smiles: COc1ccc(cc1)C(=O)c1oc2c(c1C)cc(cc2)NC(=O)c1ccncc1

STK625898
Synonyms: 5- imino- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 1- (propan- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CC(N1CC(=C(C1=N)c1scc(n1)c1ccccc1)O)C

STK856739
Synonyms: 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 6- ethyl- 4- oxo- 4H- chromen- 7- yl3- methoxybenzoate
Smiles: CCc1cc2c(cc1OC(=O)c1cccc(c1)OC)occ(c2=O)c1ccc2c(c1)OCCO2

STK856740
Synonyms: 3- (2- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl(2E)- 3- phenylprop- 2- enoate
Smiles: COc1ccccc1c1coc2c(c1=O)ccc(c2)OC(=O)/C=C/c1ccccc1

STK625907
Synonyms: 4- [(2- phosphonophenoxy)methyl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)COc1ccccc1P(=O)(O)O

STK625910
Synonyms: N- [2- (2- hydroxyethoxy)ethyl]- 1- (pyrimidin- 2- yl)piperidine- 4- carboxamide
Smiles: OCCOCCNC(=O)C1CCN(CC1)c1ncccn1

STK856741
Synonyms: 1- benzofuran- 2- yl[4- (2,3- dihydro- 1,4- benzodioxin- 2- ylcarbonyl)piperazin- 1- yl]methanone
Smiles: O=C(C1COc2c(O1)cccc2)N1CCN(CC1)C(=O)c1cc2c(o1)cccc2

STK625912
Synonyms: 6- (3- bromo- 4- fluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1Br)c1nn2c(s1)nnc2

STK856742
Synonyms: N- (1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydrobenzo[g]pteridin- 8- yl)propanamide
Smiles: CCC(=O)Nc1ccc2c(c1)nc1c(n2)c(=O)n(c(=O)n1C)C

STK625916
Synonyms: 1- methyl- 6- nitro- 1,2,3,4- tetrahydroquinoline- 3- carboxylicacid
Smiles: OC(=O)C1CN(C)c2c(C1)cc(cc2)[N+](=O)[O-]

STK625921
Synonyms: 1- (1- ethyl- 5- fluoro- 1H- indol- 3- yl)propan- 2- amine
Smiles: CCn1cc(c2c1ccc(c2)F)CC(N)C

STK625923
Synonyms: 4- ({N- [(4- chlorophenyl)carbonyl]- 3- (2- hydroxyquinolin- 4- yl)alanyl}amino)butanoicacid
Smiles: OC(=O)CCCNC(=O)C(Cc1cc(O)nc2c1cccc2)NC(=O)c1ccc(cc1)Cl

STK625925
Synonyms: 1- (1H- indol- 3- ylacetyl)- N- (thiophen- 2- ylmethyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)Cc1c[nH]c2c1cccc2)NCc1cccs1

STK625927
Synonyms: 5- (3- methoxyphenyl)- 2- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1cccc(c1)c1[nH]n(c(=O)c1)c1ccccc1

STK625928
Synonyms: trans- N- {2- [benzyl(methyl)amino]- 2- oxoethyl}- 4- {[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: CN(C(=O)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1)Cc1ccccc1

STK625929
Synonyms: 7- {2- oxo- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]ethoxy}- 3- phenyl- 4H- chromen- 4- one
Smiles: O=C(N1CCN(CC1)c1ccccn1)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK625931
Synonyms: ethyl2- {[(2Z)- 2- (3,4- dichlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}propanoate
Smiles: CCOC(=O)C(Oc1ccc2c(c1)O/C(=C\c1ccc(c(c1)Cl)Cl)/C2=O)C

STK625932
Synonyms: 1- (2,5- dimethoxybenzyl)- 3- methyl- 1- [3- (morpholin- 4- yl)propyl]thiourea
Smiles: CNC(=S)N(Cc1cc(OC)ccc1OC)CCCN1CCOCC1

STK625933
Synonyms: 4- chloro- N- (3- phenyl- 1,2- oxazol- 5- yl)benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1onc(c1)c1ccccc1

STK625934
Synonyms: 2- (4- methoxyphenyl)- N- {2- [(4- methylphenyl)sulfonyl]- 2- (pyridin- 3- yl)ethyl}acetamide
Smiles: COc1ccc(cc1)CC(=O)NCC(S(=O)(=O)c1ccc(cc1)C)c1cccnc1

STK625935
Synonyms: 2- (4- benzylpiperazin- 1- yl)- 6- (3,4- dimethoxyphenyl)pyrimidin- 4- ol
Smiles: COc1ccc(cc1OC)c1cc(O)nc(n1)N1CCN(CC1)Cc1ccccc1

STK625939
Synonyms: 7- {2- [4- (2,3- dihydro- 1,4- benzodioxin- 2- ylcarbonyl)piperazin- 1- yl]- 2- oxoethoxy}- 2,3- dihydropyrrolo[2,1- b]quinazolin- 9(1H)- one
Smiles: O=C(N1CCN(CC1)C(=O)C1COc2c(O1)cccc2)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK856744
Synonyms: ethyl{[(2Z)- 2- (3- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)O/C(=C\c1cccc(c1)C)/C2=O

STK625943
Synonyms: trans- 4- ({[(4- methylphenyl)sulfonyl]amino}methyl)- N- {2- oxo- 2- [(2- phenylethyl)amino]ethyl}cyclohexanecarboxamide
Smiles: O=C(CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)C)NCCc1ccccc1

STK625947
Synonyms: methyl3- {[(3,5- dimethoxyphenyl)carbonyl]amino}- 4- methoxy- 1H- indole- 2- carboxylate
Smiles: COc1cc(OC)cc(c1)C(=O)Nc1c([nH]c2c1c(OC)ccc2)C(=O)OC

STK625950
Synonyms: 1- methyl- 1- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]- 3- [4- (trifluoromethyl)phenyl]thiourea
Smiles: S=C(N(Cc1cc(=O)[nH]c2c1cccc2)C)Nc1ccc(cc1)C(F)(F)F

STK625952
Synonyms: N- (butan- 2- yl)- 2- (6,12- dioxo- 6,6a,7,8,9,10- hexahydropyrido[2,1- c][1,4]benzodiazepin- 5(12H)- yl)acetamide
Smiles: CCC(NC(=O)CN1C(=O)C2CCCCN2C(=O)c2c1cccc2)C

STK625955
Synonyms: 2- [(2,4- dichlorophenyl)amino]- 4- hydroxy- 1,3- diazaspiro[5.5]undeca- 1,3- diene- 5- carbonitrile
Smiles: N#CC1C(=NC(=NC21CCCCC2)Nc1ccc(cc1Cl)Cl)O

STK625956
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- [2- (trifluoromethyl)phenyl]- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: O=C(c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1)Nc1ccccc1C(F)(F)F

STK625957
Synonyms: 3- phenyl- 9- (2- phenylethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: O=c1c(coc2c1ccc1c2CN(CO1)CCc1ccccc1)c1ccccc1

STK625958
Synonyms: [4- (4- chlorophenyl)- 4- hydroxypiperidin- 1- yl](2,4- dimethyl- 1,3- thiazol- 5- yl)methanone
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)c1sc(nc1C)C

STK625960
Synonyms: N- (5- methyl- 1,3- thiazol- 2- yl)- 2- [(2- oxo- 2H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1ncc(s1)C)COc1ccc2c(c1)oc(=O)cc2

STK625965
Synonyms: N- [2- (furan- 2- yl)- 2- (pyrrolidin- 1- yl)ethyl]- 2- methoxybenzamide
Smiles: COc1ccccc1C(=O)NCC(c1ccco1)N1CCCC1

STK625972
Synonyms: N- benzyl- 2- [3- hydroxy- 4- (3- methyl- 4- phenoxy- 1H- pyrazol- 5- yl)phenoxy]- N- methylacetamide
Smiles: CN(C(=O)COc1ccc(c(c1)O)c1[nH]nc(c1Oc1ccccc1)C)Cc1ccccc1

STK625974
Synonyms: 2- [(5Z)- 5- (2- chlorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)acetamide
Smiles: O=C(CN1C(=O)S/C(=C\c2ccccc2Cl)/C1=O)Nc1ccc2c(c1)nccn2

STK625975
Synonyms: N- [2- (4- chlorophenyl)ethyl]- 2- (7H- purin- 6- ylsulfanyl)acetamide
Smiles: O=C(CSc1ncnc2c1[nH]cn2)NCCc1ccc(cc1)Cl

STK856746
Synonyms: ethyl7- (cyanomethoxy)- 3- (4- methoxyphenyl)- 4- oxo- 4H- chromene- 2- carboxylate
Smiles: CCOC(=O)c1oc2cc(OCC#N)ccc2c(=O)c1c1ccc(cc1)OC

STK625979
Synonyms: N- (4- chlorophenyl)- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1

STK625980
Synonyms: (3R)- N- (3- chloro- 4- fluorophenyl)- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: Fc1ccc(cc1Cl)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK625982
Synonyms: N- (4- chlorophenyl)- 2,2- dimethyltetrahydro- 2H- pyran- 4- amine
Smiles: Clc1ccc(cc1)NC1CCOC(C1)(C)C

STK625983
Synonyms: [4- (4- methoxyphenyl)piperazin- 1- yl][1- (9H- purin- 6- yl)piperidin- 4- yl]methanone
Smiles: COc1ccc(cc1)N1CCN(CC1)C(=O)C1CCN(CC1)c1ncnc2c1nc[nH]2

STK625985
Synonyms: 4- (3- bromophenyl)- 7- (4- hydroxyphenyl)- 3- methyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: Oc1ccc(cc1)C1CC(=C2C(=Nc3c(C2c2cccc(c2)Br)c(no3)C)C1)O

STK625988
Synonyms: N- [(2Z)- 1,3- benzothiazol- 2(3H)- ylidene]- 5- ethyl- 8- oxo- 5,8- dihydro[1,3]dioxolo[4,5- g]quinoline- 7- carboxamide
Smiles: CCn1cc(C(=O)/N=c/2\sc3c([nH]2)cccc3)c(=O)c2c1cc1OCOc1c2

STK625989
Synonyms: 4- [3- (1H- indol- 3- yl)propanoyl]- N- [(2S)- 1- oxo- 1- (pyrrolidin- 1- yl)propan- 2- yl]piperazine- 1- carboxamide
Smiles: O=C(N1CCN(CC1)C(=O)N[C@H](C(=O)N1CCCC1)C)CCc1c[nH]c2c1cccc2

STK625992
Synonyms: 3- {(Z)- [2- (2- fluorophenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}- N,N- dimethyl- 1H- indole- 1- sulfonamide
Smiles: O=C1OC(=N/C/1=C\c1cn(c2c1cccc2)S(=O)(=O)N(C)C)c1ccccc1F

STK625993
Synonyms: 4- [4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK625997
Synonyms: N- [(2E)- 5- [(2- methylbenzyl)sulfonyl]- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2,2- diphenylacetamide
Smiles: O=C(C(c1ccccc1)c1ccccc1)/N=c/1\[nH]nc(s1)S(=O)(=O)Cc1ccccc1C

STK625998
Synonyms: 7- (1H- indol- 3- yl)- 3- phenyl- 4H- [1,3,4]thiadiazolo[2,3- c][1,2,4]triazin- 4- one
Smiles: O=c1c(nnc2n1nc(s2)c1c[nH]c2c1cccc2)c1ccccc1

STK625999
Synonyms: (2Z)- 2- (3- chlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methoxybenzenesulfonate
Smiles: COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)Cl)/C2=O

STK856750
Synonyms: 3- [(2- methoxyethoxy)carbonyl]- 2- methyl- 1- benzofuran- 5- yl1- benzofuran- 2- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1cc2c(o1)cccc2

STK626001
Synonyms: 2- {[3- (4- chlorophenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}- N- [3- (propan- 2- yloxy)propyl]acetamide
Smiles: O=C(COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C)NCCCOC(C)C

STK626003
Synonyms: ethyl3- {[N- (2- chloro- 7H- purin- 6- yl)glycyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)CNc1nc(Cl)nc2c1[nH]cn2

STK626004
Synonyms: 7- [2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 2- oxoethoxy]- 2,2- dimethyl- 2,3- dihydro- 4H- chromen- 4- one
Smiles: COc1cc2CCN(Cc2cc1OC)C(=O)COc1ccc2c(c1)OC(CC2=O)(C)C

STK626006
Synonyms: 2- ethoxy- N- [2- (piperidin- 1- ylsulfonyl)ethyl]- N- (pyridin- 4- ylmethyl)pyridine- 3- carboxamide
Smiles: CCOc1ncccc1C(=O)N(Cc1ccncc1)CCS(=O)(=O)N1CCCCC1

STK626010
Synonyms: N- (4- methoxyphenyl)- 2- [(3,4,8- trimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]acetamide
Smiles: COc1ccc(cc1)NC(=O)COc1ccc2c(c1C)oc(=O)c(c2C)C

STK626013
Synonyms: 1- benzyl- 2- hydroxy- 5- (5- methyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 5- (trifluoromethyl)- 5,7- dihydro- 1H- pyrrolo[2,3- d]pyrimidine- 4,6- dione
Smiles: Oc1nc(=O)c2c(n1Cc1ccccc1)NC(=O)C2(c1c(C)[nH]n(c1=O)c1ccccc1)C(F)(F)F

STK626014
Synonyms: 3- (3,4- dimethoxyphenyl)- 9- (3- phenylpropyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cc(ccc1OC)c1coc2c(c1=O)ccc1c2CN(CCCc2ccccc2)CO1

STK626016
Synonyms: N- [1- butyl- 4- hydroxy- 2,6- dioxo- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]- 3- cyclohexylpropanamide
Smiles: CCCCn1c(=O)nc(c2c1NC(=O)C2(NC(=O)CCC1CCCCC1)C(F)(F)F)O

STK626019
Synonyms: (5E)- 3- propyl- 5- ({4- [2- (pyridin- 2- yl)ethyl]piperazin- 1- yl}methylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: CCCN1C(=S)S/C(=C/N2CCN(CC2)CCc2ccccn2)/C1=O

STK856752
Synonyms: (2Z)- 2- (1,3- benzodioxol- 5- ylmethylidene)- 8- (pyridin- 3- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccc3c(c2)OCO3)/Oc2c1ccc1c2CN(CO1)Cc1cccnc1

STK626025
Synonyms: N- [(2Z)- 1,3- benzothiazol- 2(3H)- ylidene]- 6- oxo- 1- phenyl- 1,4,5,6- tetrahydropyridazine- 3- carboxamide
Smiles: O=C1CCC(=NN1c1ccccc1)C(=O)/N=c/1\sc2c([nH]1)cccc2

STK626027
Synonyms: trans- N- (2- {[2- (1H- indol- 3- yl)ethyl]amino}- 2- oxoethyl)- 4- {[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C(CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1)NCCc1c[nH]c2c1cccc2

STK626028
Synonyms: 2- [(5E)- 5- (3- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [2- (1H- imidazol- 5- yl)ethyl]propanamide
Smiles: O=C(C(N1C(=S)S/C(=C/c2cccc(c2)F)/C1=O)C)NCCc1cnc[nH]1

STK626041
Synonyms: 1- [3- (6- chloro- 2- hydroxy- 4- phenylquinolin- 3- yl)- 5- (2- hydroxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]propan- 1- one
Smiles: CCC(=O)N1N=C(CC1c1ccccc1O)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

STK626043
Synonyms: N- (3- chlorophenyl)- 3- [(4S)- 1- (furan- 2- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]propanamide
Smiles: O=C(Nc1cccc(c1)Cl)CC[C@@H]1NC(=O)N(C1=O)Cc1ccco1

STK856757
Synonyms: 2- (2- methoxyphenyl)- 5- {[(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccccc1n1[nH]c(cc1=O)CSc1nnnn1c1ccccc1

STK626045
Synonyms: (3Z)- 3- [2- oxo- 1- (propan- 2- yl)- 1,2- dihydro- 3H- indol- 3- ylidene]- 1- phenylpyrrolidine- 2,5- dione
Smiles: O=C1C/C(=C/2\c3ccccc3N(C2=O)C(C)C)/C(=O)N1c1ccccc1

STK626046
Synonyms: 2- (3,4- dimethoxyphenyl)- 8,9- dimethyl- 7- (6- methylpyridin- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)n(c(c1C)C)c1cccc(n1)C

STK626047
Synonyms: 5,6- dimethyl- 3- (2- methylpropyl)- 7- (pyridin- 2- ylmethyl)- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: CC(Cn1cnc2c(c1=N)c(C)c(n2Cc1ccccn1)C)C

STK626048
Synonyms: N- (3,4- difluorophenyl)- 3- [(4S)- 1- {[4- (4- methoxyphenyl)tetrahydro- 2H- pyran- 4- yl]methyl}- 2,5- dioxoimidazolidin- 4- yl]propanamide
Smiles: COc1ccc(cc1)C1(CCOCC1)CN1C(=O)N[C@H](C1=O)CCC(=O)Nc1ccc(c(c1)F)F

STK626049
Synonyms: 3- (3- chlorophenyl)- 1- (furan- 2- ylmethyl)- 1- (4- methoxybenzyl)urea
Smiles: COc1ccc(cc1)CN(C(=O)Nc1cccc(c1)Cl)Cc1ccco1

STK626050
Synonyms: ethyl6- oxo- 2- (piperidin- 1- yl)- 4- (3,4,5- trimethoxyphenyl)- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1cc(OC)c(c(c1)OC)OC)N1CCCCC1

STK626052
Synonyms: 7- methoxy- N- (quinolin- 5- yl)- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)Nc1cccc2c1cccn2

STK626053
Synonyms: 1- {[4- methyl- 2- (4- methylphenyl)- 1,3- thiazol- 5- yl]carbonyl}piperidine- 4- carboxamide
Smiles: O=C(c1sc(nc1C)c1ccc(cc1)C)N1CCC(CC1)C(=O)N

STK626054
Synonyms: 5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- methoxy- N- (3- phenylpropyl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCCCc1ccccc1)N1C(=O)C(CS1(=O)=O)(C)C

STK626059
Synonyms: 4- hydroxy- 8- {3- [(4- methoxyphenyl)amino]propyl}- 1,6,7- trimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: COc1ccc(cc1)NCCCn1c2nc3c(n2c(c1C)C)c(O)nc(=O)n3C

STK626061
Synonyms: 3- (4- methoxyphenyl)- 9- (4- methylbenzyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)Cc1ccc(cc1)C

STK626063
Synonyms: 7- [(4- bromobenzyl)oxy]- 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 6- ethyl- 2- methyl- 4H- chromen- 4- one
Smiles: CCc1cc2c(cc1OCc1ccc(cc1)Br)oc(c(c2=O)c1ccc2c(c1)OCCO2)C

STK626064
Synonyms: 2- {[5,6- dimethyl- 7- (6- methylpyridin- 2- yl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]amino}ethanol
Smiles: OCCNc1ncnc2c1c(C)c(n2c1cccc(n1)C)C

STK626066
Synonyms: 6- acetyl- 1- [2- (dimethylamino)ethyl]- 3,5- dimethylthieno[2,3- d]pyrimidine- 2,4(1H,3H)- dione
Smiles: CN(CCn1c2sc(c(c2c(=O)n(c1=O)C)C)C(=O)C)C

STK856762
Synonyms: (2E)- 2- (pyridin- 4- ylmethylidene)- 8- [2- (thiophen- 2- yl)ethyl]- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C\c2ccncc2)/Oc2c1ccc1c2CN(CO1)CCc1cccs1

STK856763
Synonyms: methyl4- {[7- (2- amino- 2- oxoethoxy)- 4- oxo- 4H- chromen- 3- yl]oxy}benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)OCC(=O)N

STK626074
Synonyms: 4- [1- hydroxy- 3,11- bis(3,4,5- trimethoxyphenyl)- 2,3,4,11- tetrahydro- 10H- dibenzo[b,e][1,4]diazepin- 5- ium- 10- yl]- 4- oxobutanoate
Smiles: COc1cc(cc(c1OC)OC)C1CC(=C2C(=[NH+]c3ccccc3N(C2c2cc(OC)c(c(c2)OC)OC)C(=O)CCC(=O)[O-])C1)O

STK626076
Synonyms: 2- [(8- methoxy- 4- methylquinazolin- 2- yl)amino]- 6- phenylpyrimidin- 4- ol
Smiles: COc1cccc2c1nc(Nc1nc(O)cc(n1)c1ccccc1)nc2C

STK626077
Synonyms: N- (tert- butoxycarbonyl)- beta- alanyl- N- [(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)methyl]alaninamide
Smiles: O=C(NC(C(=O)NCc1cc(=O)n(c(=O)n1C)C)C)CCNC(=O)OC(C)(C)C

STK626078
Synonyms: 9- cyclopropyl- 3- (4- methoxyphenyl)- 9,10- dihydro- 2H,8H- chromeno[8,7- e][1,3]oxazin- 2- one
Smiles: COc1ccc(cc1)c1cc2ccc3c(c2oc1=O)CN(CO3)C1CC1

STK626080
Synonyms: (2E)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- (acetylamino)benzenesulfonate
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK626081
Synonyms: 3- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]propanamide
Smiles: O=C(Nc1ccc(cc1)Cn1cncn1)CCn1c(O)nc2c(c1=O)cccc2

STK626084
Synonyms: 4- bromo- N- [1- oxo- 1- (3,5,6,7- tetrahydro- 1'H- spiro[imidazo[4,5- c]pyridine- 4,4'- piperidin]- 1'- yl)propan- 2- yl]benzamide
Smiles: Brc1ccc(cc1)C(=O)NC(C(=O)N1CCC2(CC1)NCCc1c2[nH]cn1)C

STK626086
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- [1- (furan- 2- yl)propan- 2- yl]acetamide
Smiles: CC(Cc1ccco1)NC(=O)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK626087
Synonyms: 7- methoxy- N- (4- sulfamoylbenzyl)- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)NCc1ccc(cc1)S(=O)(=O)N

STK626088
Synonyms: N- {3- [(3- fluorophenyl)amino]- 3- oxopropyl}- 4- (1H- indol- 2- ylcarbonyl)piperazine- 1- carboxamide
Smiles: O=C(Nc1cccc(c1)F)CCNC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK626089
Synonyms: 5- {[(5- amino- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}- 2- (methylsulfanyl)[1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CSc1nn2c(n1)nc(cc2O)CSc1nnc(s1)N

STK626090
Synonyms: 3- ethoxy- N- {4- [4- (propan- 2- yl)phenyl]- 1,2,5- oxadiazol- 3- yl}benzamide
Smiles: CCOc1cccc(c1)C(=O)Nc1nonc1c1ccc(cc1)C(C)C

STK626091
Synonyms: 3- {[2- (methylsulfanyl)- 7,8- dihydro- 6H- thiopyrano[3,2- d]pyrimidin- 4- yl]amino}propan- 1- ol
Smiles: OCCCNc1nc(SC)nc2c1SCCC2

STK626092
Synonyms: N- (2- {[(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)methyl]amino}- 2- oxoethyl)- 1H- indole- 3- carboxamide
Smiles: O=C(NCc1cc(=O)n(c(=O)n1C)C)CNC(=O)c1c[nH]c2c1cccc2

STK626093
Synonyms: 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl]- 3- (pyridin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2c1ccccn1)C

STK626094
Synonyms: 4- (3- hydroxypropyl)- 5- (pyridin- 4- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: OCCCn1c(n[nH]c1=S)c1ccncc1

STK626095
Synonyms: 7- [2- (6,7- dimethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl)- 2- oxoethoxy]spiro[chromene- 2,1'- cyclohexan]- 4(3H)- one
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)COc1ccc2c(c1)OC1(CC2=O)CCCCC1

STK626098
Synonyms: (2Z)- 2- (3,4- dichlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldiethylcarbamate
Smiles: CCN(C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(c(c1)Cl)Cl)/C2=O)CC

STK626099
Synonyms: 4- (1,3- benzothiazol- 2- yl)- 5- imino- 1- {[(E)- pyridin- 4- ylmethylidene]amino}- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2nc3c(s2)cccc3)C(=N)N(C1)/N=C/c1ccncc1

STK856765
Synonyms: 3- (4- chlorophenyl)- 5- [2- (3,5- dimethyl- 1H- pyrazol- 1- yl)ethyl]- 1,2,4- oxadiazole
Smiles: Clc1ccc(cc1)c1noc(n1)CCn1nc(cc1C)C

STK856767
Synonyms: 5- [2- (3,5- dimethyl- 1,2- oxazol- 4- yl)ethyl]- 3- phenyl- 1,2,4- oxadiazole
Smiles: Cc1onc(c1CCc1onc(n1)c1ccccc1)C

STK626102
Synonyms: (2Z)- 2- (2- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: CCOc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C(C)(C)C

STK626103
Synonyms: 5- amino- 1- (2- methylphenyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: Cc1ccccc1n1nnc(c1N)C(=O)N

STK626107
Synonyms: (2E)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK626109
Synonyms: N- (2- hydroxyethyl)- N'- (5- methyl- 1,2- oxazol- 3- yl)ethanediamide
Smiles: Cc1cc(no1)NC(=O)C(=O)NCCO

STK856768
Synonyms: 2- methoxyethyl6- bromo- 2- methyl- 5- {[(2E)- 3- phenylprop- 2- en- 1- yl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OC/C=C/c1ccccc1)c(c2)Br

STK626113
Synonyms: 6- {1- [4- (2- methylpropyl)phenyl]ethyl}- 3- (pyridin- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1ccc(cc1)C(c1nn2c(s1)nnc2c1cccnc1)C)C

STK626115
Synonyms: 4- {2- [4- hydroxy- 2- imino- 3- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 1- yl]ethyl}benzenesulfonamide
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)CCc1ccc(cc1)S(=O)(=O)N

STK626117
Synonyms: 1- (4- hydroxy- 5,6- dimethylpyrimidin- 2- yl)- 3- (4- phenoxyphenyl)guanidine
Smiles: N=C(Nc1nc(C)c(c(n1)O)C)Nc1ccc(cc1)Oc1ccccc1

STK626118
Synonyms: methyl2- (2- amino- 4- hydroxy- 6- methylpyrimidin- 5- yl)propanoate
Smiles: COC(=O)C(c1c(C)nc(nc1O)N)C

STK626119
Synonyms: [(5Z)- 4- oxo- 5- (quinoxalin- 5- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl](phenyl)aceticacid
Smiles: OC(=O)C(N1C(=S)S/C(=C\c2cccc3c2nccn3)/C1=O)c1ccccc1

STK626121
Synonyms: 4- fluoro- N- [4- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2,5- oxadiazol- 3- yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1nonc1c1ccc2c(c1)CCCC2

STK626122
Synonyms: 3- (3- hydroxy- 5- phenyl- 1H- pyrazol- 4- yl)- 6,7- dimethoxy- 2- benzofuran- 1(3H)- one
Smiles: COc1c(OC)ccc2c1C(=O)OC2c1c(O)n[nH]c1c1ccccc1

STK626124
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CCSc1nc(Cl)nc2c1[nH]cn2

STK626126
Synonyms: 5- (furan- 2- yl)- 2- hydroxy- 1- (tetrahydrofuran- 2- ylmethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1c(ccn2)c1ccco1)CC1CCCO1

STK626127
Synonyms: N- [(trans- 4- {[4- (2- fluorophenyl)piperazin- 1- yl]carbonyl}cyclohexyl)methyl]benzenesulfonamide
Smiles: O=C(N1CCN(CC1)c1ccccc1F)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1

STK626128
Synonyms: 1- (2,1,3- benzothiadiazol- 4- ylsulfonyl)- N- [2- (thiophen- 2- yl)ethyl]piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2)NCCc1cccs1

STK626129
Synonyms: ethyl[2- (2- {[(6- chloropyridin- 3- yl)carbonyl]amino}ethyl)- 1- methyl- 1H- benzimidazol- 5- yl]carbamate
Smiles: CCOC(=O)Nc1ccc2c(c1)nc(n2C)CCNC(=O)c1ccc(nc1)Cl

STK626130
Synonyms: 8- amino- 7- hexadecyl- 2- hydroxy- 3- methyl- 3,7- dihydro- 6H- purin- 6- one
Smiles: CCCCCCCCCCCCCCCCn1c(N)nc2c1c(=O)nc(n2C)O

STK626131
Synonyms: 1- {3- [(5Z)- 5- (2- fluorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]propanoyl}piperidine- 2- carboxylicacid
Smiles: O=C(N1CCCCC1C(=O)O)CCN1C(=O)S/C(=C\c2ccccc2F)/C1=O

STK626132
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 7H- purin- 6- amine
Smiles: C1COc2c(O1)cc(cc2)Nc1ncnc2c1[nH]cn2

STK626133
Synonyms: 3- [5- hydroxy- 5- (trifluoromethyl)- 4,5- dihydro- 1,2- oxazol- 3- yl]- 4,6- dimethylpyridin- 2- ol
Smiles: Cc1cc(C)c(c(n1)O)C1=NOC(C1)(O)C(F)(F)F

STK626135
Synonyms: (3Z)- 6- chloro- 3- (4- methylbenzylidene)- 1- [(4- methylpiperazin- 1- yl)methyl]- 1,3- dihydro- 2H- indol- 2- one
Smiles: CN1CCN(CC1)CN1C(=O)/C(=C\c2ccc(cc2)C)/c2c1cc(Cl)cc2

STK626136
Synonyms: (2Z)- 2- [(3- methylthiophen- 2- yl)methylidene]- 8- (tetrahydrofuran- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2sccc2C)/Oc2c1ccc1c2CN(CO1)CC1CCCO1

STK856771
Synonyms: (2Z)- 2- [(6- bromo- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylfuran- 2- carboxylate
Smiles: Brc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OC(=O)c2ccco2)c2c(c1)COCO2

STK626138
Synonyms: 3- cyano- 7- (4- hydroxyphenyl)- 5- methyl- N- (2- methylphenyl)- 1,7- dihydropyrazolo[1,5- a]pyrimidine- 6- carboxamide
Smiles: N#Cc1c[nH]n2c1=NC(=C(C2c1ccc(cc1)O)C(=O)Nc1ccccc1C)C

STK626140
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- [2- (4- hydroxyphenyl)ethyl]propanamide
Smiles: O=C(CCSc1nc(Cl)nc2c1[nH]cn2)NCCc1ccc(cc1)O

STK626141
Synonyms: (1E)- (6,9- dimethyl- 2,3- dihydrocyclopenta[c]furo[3,2- g]chromen- 4(1H)- ylidene)hydrazine
Smiles: N/N=c\1/oc2c(c3c1CCC3)cc1c(c2C)occ1C

STK626143
Synonyms: 3- (3- chloro- 1,2- oxazol- 5- yl)- N- (pyridin- 4- ylmethyl)- N- [2- (pyrrolidin- 1- ylsulfonyl)ethyl]propanamide
Smiles: O=C(N(Cc1ccncc1)CCS(=O)(=O)N1CCCC1)CCc1onc(c1)Cl

STK626145
Synonyms: N- [2- hydroxy- 5- oxo- 1- (pyridin- 3- ylmethyl)- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]pyridine- 3- carboxamide
Smiles: O=C(c1cccnc1)NC1(N=C(N(C1=O)Cc1cccnc1)O)C(F)(F)F

STK626147
Synonyms: N- [1- (2- chlorobenzyl)- 3,5- dimethyl- 1H- pyrazol- 4- yl]- N'- [2- (dimethylamino)ethyl]ethanediamide
Smiles: CN(CCNC(=O)C(=O)Nc1c(C)nn(c1C)Cc1ccccc1Cl)C

STK626148
Synonyms: 6- fluoro- 1- methyl- 7- {4- [(5- methyl- 2- oxo- 1,3- dioxol- 4- yl)methyl]piperazin- 1- yl}- 4- oxo- 4H- [1,3]thiazeto[3,2- a]quinoline- 3- carboxylicacid
Smiles: O=c1oc(c(o1)CN1CCN(CC1)c1cc2c(cc1F)c(=O)c(c1n2C(C)S1)C(=O)O)C

STK626150
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (4- phenylbutan- 2- yl)acetamide
Smiles: CC(NC(=O)CSc1nc(Cl)nc2c1[nH]cn2)CCc1ccccc1

STK626151
Synonyms: (5E)- 5- [(8- methoxyquinolin- 2- yl)methylidene]- 3- methyl- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1cccc2c1nc(cc2)/C=C\1/SC(=S)N(C1=O)C

STK626152
Synonyms: 8- (dimethylamino)- 2- hydroxy- 3- (1- phenylethyl)benzo[g]pteridin- 4(3H)- one
Smiles: CN(c1ccc2c(c1)nc1c(n2)c(=O)n(c(n1)O)C(c1ccccc1)C)C

STK626153
Synonyms: (2Z)- 2- (1,3- benzodioxol- 5- ylmethylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzoate
Smiles: Fc1ccc(cc1)C(=O)Oc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O

STK626154
Synonyms: 2,3,5,6- tetrafluoro- 4- [(2- hydroxyethyl)sulfonyl]benzoicacid
Smiles: OCCS(=O)(=O)c1c(F)c(F)c(c(c1F)F)C(=O)O

STK626155
Synonyms: N- (5- methyl- 1,3- thiazol- 2- yl)- 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]acetamide
Smiles: O=C(Nc1ncc(s1)C)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK626156
Synonyms: 3- (4- chlorophenyl)- 8- [(dimethylammonio)methyl]- 4- methyl- 2- oxo- 2H- chromen- 7- olate
Smiles: C[NH+](Cc1c([O-])ccc2c1oc(=O)c(c2C)c1ccc(cc1)Cl)C

STK626162
Synonyms: {(5E)- 5- [(6- hydroxy[1,3]dioxolo[4,5- g]quinolin- 7- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}aceticacid
Smiles: Oc1nc2cc3OCOc3cc2cc1/C=C\1/SC(=S)N(C1=O)CC(=O)O

STK626164
Synonyms: 1- cyclopropyl- 6,7- difluoro- N- (3- hydroxyphenyl)- 8- methoxy- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)Nc1cccc(c1)O)C1CC1

STK626166
Synonyms: 9- fluoro- 3- (thiophen- 2- ylmethyl)[1,2,4]triazolo[4,3- c]quinazoline
Smiles: Fc1ccc2c(c1)c1nnc(n1cn2)Cc1cccs1

STK626167
Synonyms: 5,7,8- trifluoro- 4- (3- methoxypropyl)- 3,4- dihydro- 2H- pyrido[4,3- b][1,4]thiazine1,1- dioxide
Smiles: COCCCN1CCS(=O)(=O)c2c1c(F)nc(c2F)F

STK626168
Synonyms: N- {3- [(4- methylphenyl)sulfonyl]- 1- pentyl- 1H- pyrrolo[2,3- b]quinoxalin- 2- yl}furan- 2- carboxamide
Smiles: CCCCCn1c2nc3ccccc3nc2c(c1NC(=O)c1ccco1)S(=O)(=O)c1ccc(cc1)C

STK626170
Synonyms: methyl4- [(2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)methyl]cyclohexanecarboxylate
Smiles: COC(=O)C1CCC(CC1)Cn1c(O)nc2c(c1=O)cccc2

STK626173
Synonyms: 2- [3- (4- chlorophenyl)- 5- methyl- 7- oxo- 7H- furo[3,2- g]chromen- 6- yl]- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- methylacetamide
Smiles: Clc1ccc(cc1)c1coc2c1cc1c(c2)oc(=O)c(c1C)CC(=O)N(C1CCS(=O)(=O)C1)C

STK626174
Synonyms: N- (furan- 2- ylmethyl)- N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]alaninamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)NCc1ccco1)C

STK626175
Synonyms: (2Z)- 2- (3,4- dimethoxybenzylidene)- 8- [2- (morpholin- 4- yl)ethyl]- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CCN2CCOCC2)CO1

STK626176
Synonyms: 6- (difluoromethoxy)- 2- [(1,1- dioxido- 2,3- dihydrothiophen- 3- yl)sulfanyl]- 1H- benzimidazole
Smiles: FC(Oc1ccc2c(c1)[nH]c(n2)SC1C=CS(=O)(=O)C1)F

STK626183
Synonyms: 1- (4- benzylpiperazin- 1- yl)- 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]propan- 1- one
Smiles: O=C(C(Sc1nc(Cl)nc2c1[nH]cn2)C)N1CCN(CC1)Cc1ccccc1

STK626185
Synonyms: N- (3,4- dimethoxyphenyl)- 2- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: COc1cc(ccc1OC)NC(=O)c1ccc2c(c1)sc(n2)n1c(C)ccc1C

STK626186
Synonyms: 2- {[2- (3- methoxyphenyl)- 2- oxoethyl]sulfanyl}- 5- (thiophen- 2- ylcarbonyl)- 6- (trifluoromethyl)pyridine- 3- carbonitrile
Smiles: N#Cc1cc(C(=O)c2cccs2)c(nc1SCC(=O)c1cccc(c1)OC)C(F)(F)F

STK626190
Synonyms: 6- [4- (1,2- benzothiazol- 3- yl)piperazin- 1- yl]- 2- chloro- 7H- purine
Smiles: Clc1nc(N2CCN(CC2)c2nsc3c2cccc3)c2c(n1)nc[nH]2

STK856773
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)benzamide
Smiles: O=C(c1ccccc1)NC1C=CS(=O)(=O)C1

STK626200
Synonyms: propan- 2- yl(2Z)- 2- {[(5- bromopyridin- 3- yl)carbonyl]imino}- 2,3- dihydro- 1,3- benzothiazole- 6- carboxylate
Smiles: CC(OC(=O)c1ccc2c(c1)s/c(=N\C(=O)c1cncc(c1)Br)/[nH]2)C

STK626204
Synonyms: 1- (3,5- dimethylphenyl)- 4- (4- hydroxy- 3- methoxyphenyl)- 3- methyl- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: COc1cc(ccc1O)C1CC(=Nc2c1c(C)nn2c1cc(C)cc(c1)C)O

STK626205
Synonyms: 1- cyclopropyl- 6,7- difluoro- 8- methoxy- 4- oxo- N- (1,3- thiazol- 2- yl)- 1,4- dihydroquinoline- 3- carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)Nc1nccs1)C1CC1

STK626210
Synonyms: N- (furan- 2- ylmethyl)- Nalpha- {[4- (1H- indol- 3- ylcarbonyl)piperazin- 1- yl]carbonyl}- L- phenylalaninamide
Smiles: O=C(N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2)N[C@H](C(=O)NCc1ccco1)Cc1ccccc1

STK626214
Synonyms: (2Z)- 8- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2- (pyridin- 4- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccncc2)/Oc2c1ccc1c2CN(CO1)c1ccc2c(c1)OCCO2

STK626215
Synonyms: (2Z)- 2- (3- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: Cc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C(C)(C)C

STK626216
Synonyms: 2- {[3- (4- chlorophenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (pyridin- 4- yl)acetamide
Smiles: O=C(Nc1ccncc1)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C

STK856775
Synonyms: methyl2- {[(3- hydroxy- 2H- 1,4- benzothiazin- 2- yl)acetyl]amino}thiophene- 3- carboxylate
Smiles: COC(=O)c1ccsc1NC(=O)CC1Sc2ccccc2N=C1O

STK626220
Synonyms: 2- hydroxy- 5- {(5E)- 5- [(6- methoxyquinolin- 2- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzoicacid
Smiles: COc1ccc2c(c1)ccc(n2)/C=C\1/SC(=S)N(C1=O)c1ccc(c(c1)C(=O)O)O

STK626221
Synonyms: N- benzyl- 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]propanamide
Smiles: O=C(NCc1ccccc1)CCSc1nc(Cl)nc2c1[nH]cn2

STK626223
Synonyms: N- ({1- [(5,7- dimethoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetyl]piperidin- 3- yl}carbonyl)glycine
Smiles: COc1cc(OC)cc2c1c(C)c(c(=O)o2)CC(=O)N1CCCC(C1)C(=O)NCC(=O)O

STK626226
Synonyms: 2- {[1- (5- chloro- 2- methoxyphenyl)- 5,5- dioxido- 3a,4,6,6a- tetrahydro- 1H- thieno[3,4- d]imidazol- 2- yl]sulfanyl}- N,N- dimethylacetamide
Smiles: COc1ccc(cc1N1C(=NC2C1CS(=O)(=O)C2)SCC(=O)N(C)C)Cl

STK626228
Synonyms: N- (5- chloropyridin- 2- yl)- 2- (4- methylpiperazin- 1- yl)- 2- oxoacetamide
Smiles: CN1CCN(CC1)C(=O)C(=O)Nc1ccc(cn1)Cl

STK856776
Synonyms: 7- ethyl- 2- [(4- fluorophenyl)amino]- 8- methyl- 4- (pyridin- 3- yl)- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: CCc1c(C)[nH]c2=NC(=NC(n2c1=O)c1cccnc1)Nc1ccc(cc1)F

STK626233
Synonyms: (5E)- 5- (2H- chromen- 3- ylmethylidene)- 3- (3- fluorophenyl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: Fc1cccc(c1)N1C(=S)S/C(=C/C2=Cc3c(OC2)cccc3)/C1=O

STK626235
Synonyms: 6- (3- bromo- 4- fluorophenyl)- 3- (pyridin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1Br)c1nn2c(s1)nnc2c1ccccn1

STK626239
Synonyms: 4- methyl- 1- (pentan- 2- yl)- 1H- pyrazolo[3,4- b]pyridine- 3,6- diol
Smiles: CCCC(n1nc(c2c1nc(O)cc2C)O)C

STK626240
Synonyms: N- [4- (chloroacetyl)phenyl]- 2- methylpropanamide
Smiles: ClCC(=O)c1ccc(cc1)NC(=O)C(C)C

STK626242
Synonyms: N- [2- (dimethylamino)ethyl]- 2- (6'- methyl- 8'- oxo- 3',4'- dihydro- 8'H- spiro[cyclohexane- 1,2'- pyrano[3,2- g]chromen]- 7'- yl)acetamide
Smiles: CN(CCNC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2)C

STK626243
Synonyms: N- [(2Z)- 3- methyl- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]- 2- phenoxypropanamide
Smiles: CC(C(=O)/N=C/1\SC2C(N1C)CS(=O)(=O)C2)Oc1ccccc1

STK626247
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- cyclopropylpiperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)NC1CC1

STK626250
Synonyms: 2- {1- [2- (phenylsulfanyl)ethyl]piperidin- 4- yl}- 1,3- benzothiazole
Smiles: c1ccc(cc1)SCCN1CCC(CC1)c1nc2c(s1)cccc2

STK626251
Synonyms: 1- [3- (4- bromophenyl)- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 2- methylpropan- 1- one
Smiles: Brc1ccc(cc1)C1=NN(C(C1)c1ccc2c(c1)nccn2)C(=O)C(C)C

STK856779
Synonyms: 5- amino- N- (2- methoxyphenyl)- 1- (2- methylphenyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: COc1ccccc1NC(=O)c1nnn(c1N)c1ccccc1C

STK626255
Synonyms: 8,9- dimethyl- 2,3- dihydrocyclopenta[c]furo[3,2- g]chromene- 4(1H)- thione
Smiles: Cc1oc2c(c1C)cc1c(c2)oc(=S)c2c1CCC2

STK626256
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- (2- methoxyphenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccccc1c1nnc2n1nc(s2)c1cncc(c1)Br

STK626257
Synonyms: N~2~- (2- chloro- 7H- purin- 6- yl)- N- (2- phenylethyl)glycinamide
Smiles: O=C(CNc1nc(Cl)nc2c1[nH]cn2)NCCc1ccccc1

STK626261
Synonyms: N- ({1- [(4- methoxyphenyl)sulfonyl]piperidin- 3- yl}carbonyl)- L- alanine
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)N[C@H](C(=O)O)C

STK626262
Synonyms: 3- [(4S)- 1- benzyl- 2,5- dioxoimidazolidin- 4- yl]- N- [3- (morpholin- 4- yl)propyl]propanamide
Smiles: O=C(CC[C@@H]1NC(=O)N(C1=O)Cc1ccccc1)NCCCN1CCOCC1

STK626265
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: Fc1ccc2c(c1)c(CCNC(=O)c1ccc3c(c1)sc(n3)n1cccc1)c[nH]2

STK626266
Synonyms: piperidin- 1- yl[2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]methanone
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)N1CCCCC1

STK626268
Synonyms: N- (4- methylpiperazin- 1- yl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: CN1CCN(CC1)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK626270
Synonyms: 2- (morpholin- 4- yl)- N- (quinolin- 5- yl)pyridine- 4- carboxamide
Smiles: O=C(c1ccnc(c1)N1CCOCC1)Nc1cccc2c1cccn2

STK626271
Synonyms: 2- hydroxy- 5- (2- methoxyphenyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COc1ccccc1c1ccnc2c1c(=O)nc([nH]2)O

STK626274
Synonyms: 2- (2- chlorophenyl)- N- [(2Z)- 3- methyl- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(Cc1ccccc1Cl)/N=C/1\SC2C(N1C)CS(=O)(=O)C2

STK626275
Synonyms: 4- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- (furan- 2- ylmethyl)benzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)NCc2ccco2)S(=O)(=O)CC1(C)C

STK626280
Synonyms: (4- ethoxy- 3- methoxyphenyl)(1- methyl- 1H- imidazol- 2- yl)methanol
Smiles: CCOc1ccc(cc1OC)C(c1nccn1C)O

STK626282
Synonyms: 3- (acetylamino)- N- [(2E)- 4- (5- methoxy- 1,2- dimethyl- 1H- indol- 3- yl)- 1,3- thiazol- 2(3H)- ylidene]benzamide
Smiles: COc1ccc2c(c1)c(c1cs/c(=N/C(=O)c3cccc(c3)NC(=O)C)/[nH]1)c(n2C)C

STK626285
Synonyms: 4- (4- methoxyphenyl)- 3,7,7- trimethyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: COc1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)(C)C

STK626287
Synonyms: 3- {(5E)- 5- [(7- hydroxy- 2,3- dihydro[1,4]dioxino[2,3- g]quinolin- 8- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}propanoicacid
Smiles: Oc1nc2cc3OCCOc3cc2cc1/C=C\1/SC(=S)N(C1=O)CCC(=O)O

STK856783
Synonyms: propan- 2- yl{[3- (2- chlorophenoxy)- 4- oxo- 4H- chromen- 7- yl]oxy}acetate
Smiles: CC(OC(=O)COc1ccc2c(c1)occ(c2=O)Oc1ccccc1Cl)C

STK626288
Synonyms: trans- N- {2- [benzyl(methyl)amino]- 2- oxoethyl}- 4- ({[(4- methylphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: O=C([C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)C)NCC(=O)N(Cc1ccccc1)C

STK626289
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- [2- (6- methoxy- 1H- indol- 3- yl)ethyl]piperidine- 4- carboxamide
Smiles: COc1ccc2c(c1)[nH]cc2CCNC(=O)C1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2

STK626291
Synonyms: N- [(2Z)- 5- (ethylsulfonyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- (2- fluorophenoxy)butanamide
Smiles: CCC(C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)CC)Oc1ccccc1F

STK626295
Synonyms: 2- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- [3- (morpholin- 4- yl)propyl]acetamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)NCCCN1CCOCC1

STK856784
Synonyms: (2Z)- 2- (3- methoxybenzylidene)- 8- (pyridin- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccccn1

STK626298
Synonyms: methyl4- [({(2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)COc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK626299
Synonyms: N- (4- tert- butylphenyl)- 2- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)Nc1ccc(cc1)C(C)(C)C

STK626300
Synonyms: (5Z)- 3- (furan- 2- ylmethyl)- 5- (quinoxalin- 5- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2cccc3c2nccn3)/C(=O)N1Cc1ccco1

STK626303
Synonyms: 2- bromo- N- [2- (6- ethyl- 2- oxo- 2H- chromen- 4- yl)- 1- benzofuran- 3- yl]benzamide
Smiles: CCc1ccc2c(c1)c(cc(=O)o2)c1oc2c(c1NC(=O)c1ccccc1Br)cccc2

STK626304
Synonyms: N- (2- hydroxyethyl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: OCCNC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK626308
Synonyms: ethyl7- (4- hydroxyphenyl)- 2- methyl- 5- propyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidine- 6- carboxylate
Smiles: CCOC(=O)C1=C(CCC)N=c2n(C1c1ccc(cc1)O)nc([nH]2)C

STK626312
Synonyms: 2- [(4,8- dimethyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(Nc1nccs1)COc1ccc2c(c1C)oc(=O)cc2C

STK626315
Synonyms: 3- (1,3- benzodioxol- 5- ylmethyl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: OC1C(Cc2ccc3c(c2)OCO3)NS(=O)(=O)c2c1cccc2

STK626316
Synonyms: {2- [5- hydroxy- 4- methyl- 4- (propan- 2- yl)- 4H- imidazol- 2- yl]quinolin- 3- yl}(4- phenylpiperazin- 1- yl)methanone
Smiles: CC(C1(C)N=C(N=C1O)c1nc2ccccc2cc1C(=O)N1CCN(CC1)c1ccccc1)C

STK626318
Synonyms: 3- [(4S)- 1- (1,3- benzodioxol- 5- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]- N- (3- chlorobenzyl)propanamide
Smiles: O=C(NCc1cccc(c1)Cl)CC[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2

STK626321
Synonyms: (2E)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylcyclopropanecarboxylate
Smiles: O=C(C1CC1)Oc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK626326
Synonyms: N- {2- [(4- methoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 6- yl}- 2- (4- oxoquinazolin- 3(4H)- yl)acetamide
Smiles: COc1ccc(cc1)C(=O)c1oc2c(c1C)ccc(c2)NC(=O)Cn1cnc2c(c1=O)cccc2

STK626327
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK626331
Synonyms: 4- (1H- indol- 3- ylcarbonyl)- N- {(2S)- 1- [(3- methoxybenzyl)amino]- 1- oxopropan- 2- yl}piperazine- 1- carboxamide
Smiles: COc1cccc(c1)CNC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2)C

STK626333
Synonyms: N- [2- hydroxy- 5- oxo- 1- (2- phenylethyl)- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]thiophene- 2- carboxamide
Smiles: OC1=NC(C(=O)N1CCc1ccccc1)(NC(=O)c1cccs1)C(F)(F)F

STK626337
Synonyms: (3Z)- 3- (3- hydroxybenzylidene)- 2- (propan- 2- yl)- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: Oc1cccc(c1)/C=C\1/C(=O)c2ccccc2S(=O)(=O)N1C(C)C

STK626339
Synonyms: N- (3- chlorophenyl)- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: Clc1cccc(c1)NC(=O)c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1

STK626341
Synonyms: 3- {2- [(1,3- benzothiazol- 2- ylsulfanyl)methyl]- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl}propan- 1- ol
Smiles: OCCCn1c2ncn3c(c2c(c1C)C)nc(n3)CSc1nc2c(s1)cccc2

STK626347
Synonyms: 3- (4- fluorophenyl)- 2,5- dimethyl- N- (pyridin- 3- ylmethyl)pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Fc1ccc(cc1)c1c(C)nn2c1nc(C)cc2NCc1cccnc1

STK856786
Synonyms: N- (2- fluorophenyl)- 2,3- dihydrothiophen- 3- amine1,1- dioxide
Smiles: Fc1ccccc1NC1C=CS(=O)(=O)C1

STK626352
Synonyms: 2- [(1Z)- 1- (4- methylphenyl)- 3- (pyrrolidin- 1- yl)prop- 1- en- 1- yl]pyridine
Smiles: Cc1ccc(cc1)/C(=C/CN1CCCC1)/c1ccccn1

STK626358
Synonyms: 3- {3- [(4- bromophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}- 1H- indole
Smiles: Brc1ccc(cc1)OCc1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK626362
Synonyms: (2R)- ({[2- (4- methoxyphenyl)- 1,3- thiazol- 4- yl]acetyl}amino)(phenyl)ethanoicacid
Smiles: COc1ccc(cc1)c1scc(n1)CC(=O)N[C@H](c1ccccc1)C(=O)O

STK626364
Synonyms: 3- (6- fluoro- 1H- indol- 1- yl)- N- (pyridin- 4- ylmethyl)propanamide
Smiles: O=C(CCn1ccc2c1cc(F)cc2)NCc1ccncc1

STK626365
Synonyms: S- methyl- N- [(6'- methyl- 8'- oxo- 3',4'- dihydro- 8'H- spiro[cyclohexane- 1,2'- pyrano[3,2- g]chromen]- 7'- yl)acetyl]- L- cysteine
Smiles: CSC[C@@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2

STK626366
Synonyms: ethyl2- [4- (4- fluorophenyl)piperazin- 1- yl]- 4- (4- methoxyphenyl)- 6- oxo- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccc(cc1)OC)N1CCN(CC1)c1ccc(cc1)F

STK626367
Synonyms: 5- ({2- [(5Z)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(C(N1C(=S)S/C(=C\c2ccccc2)/C1=O)C)Nc1ccc(c(c1)C(=O)O)O

STK626368
Synonyms: 2- [4- (5- cyano- 3,3- dimethyl- 8- phenyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridin- 6- yl)piperazin- 1- yl]- N- (2- hydroxyethyl)- 2- oxoacetamide
Smiles: OCCNC(=O)C(=O)N1CCN(CC1)c1nc(c2ccccc2)c2c(c1C#N)CC(OC2)(C)C

STK626371
Synonyms: propan- 2- yl3- amino- 4- (furan- 2- yl)- 6- methyl- 5,6,7,8- tetrahydrothieno[2,3- b][1,6]naphthyridine- 2- carboxylate
Smiles: CN1CCc2c(C1)c(c1ccco1)c1c(n2)sc(c1N)C(=O)OC(C)C

STK626372
Synonyms: methyl5- ethyl- 2- {[(3- hydroxy- 1,2- dihydroquinoxalin- 2- yl)acetyl]amino}thiophene- 3- carboxylate
Smiles: COC(=O)c1cc(sc1NC(=O)CC1Nc2ccccc2N=C1O)CC

STK626373
Synonyms: 3- {3- [(2,4- dichlorophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}- 1H- indole
Smiles: Clc1ccc(c(c1)Cl)OCc1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK626375
Synonyms: 2- chloro- N- [2- (3,4- dimethoxyphenyl)ethyl]- 7H- purin- 6- amine
Smiles: COc1cc(CCNc2nc(Cl)nc3c2[nH]cn3)ccc1OC

STK626380
Synonyms: (2Z)- 2- (3- fluorobenzylidene)- 8- (furan- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Fc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccco1

STK626381
Synonyms: N- (3- acetylphenyl)- 2- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)Nc1cccc(c1)C(=O)C

STK856787
Synonyms: 2- methoxy- 4- [(Z)- (6- methoxy- 3- oxo- 1- benzofuran- 2(3H)- ylidene)methyl]phenyldimethylcarbamate
Smiles: COc1cc(ccc1OC(=O)N(C)C)/C=C/1\Oc2c(C1=O)ccc(c2)OC

STK626389
Synonyms: 5,6- dimethyl- 7- (4- methylpyridin- 2- yl)- 3- (pyridin- 2- ylmethyl)- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: Cc1ccnc(c1)n1c(C)c(c2c1ncn(c2=N)Cc1ccccn1)C

STK626390
Synonyms: 4- methyl- N- [2- (2- oxo- 2,6,7,8- tetrahydrocyclopenta[g]chromen- 4- yl)- 1- benzofuran- 3- yl]benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1c2ccccc2oc1c1cc(=O)oc2c1cc1CCCc1c2

STK626391
Synonyms: 2- (3- cyclohexyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl)quinoline
Smiles: C1CCC(CC1)c1nnc2n1nc(s2)c1ccc2c(n1)cccc2

STK626392
Synonyms: 1- [3- (1H- indol- 3- yl)propanoyl]- N- (3- methoxybenzyl)piperidine- 3- carboxamide
Smiles: COc1cccc(c1)CNC(=O)C1CCCN(C1)C(=O)CCc1c[nH]c2c1cccc2

STK626393
Synonyms: (4- benzylpiperazin- 1- yl)(1H- indol- 5- yl)methanone
Smiles: O=C(c1ccc2c(c1)cc[nH]2)N1CCN(CC1)Cc1ccccc1

STK626394
Synonyms: (2E)- 2- (pyridin- 3- ylmethylidene)- 8- [2- (thiophen- 2- yl)ethyl]- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C\c2cccnc2)/Oc2c1ccc1c2CN(CO1)CCc1cccs1

STK626397
Synonyms: 2,5,6- trihydroxy- 5- (2- oxo- 2- phenylethyl)pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)C(C(=N1)O)(O)CC(=O)c1ccccc1

STK626401
Synonyms: ethyl{[(2Z)- 2- (4- tert- butylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)(C)C)/C2=O

STK626402
Synonyms: 2- [(3- hydroxypropyl)amino]- 6H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4- ol
Smiles: OCCCNc1nc(O)c2c(n1)c1ccccc1CC12CCCCC1

STK626406
Synonyms: N- [1- (2- chlorobenzyl)- 4- hydroxy- 2,6- dioxo- 5- (trifluoromethyl)- 2,5,6,7- tetrahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]thiophene- 2- carboxamide
Smiles: O=C(c1cccs1)NC1(C(=O)Nc2c1c(O)nc(=O)n2Cc1ccccc1Cl)C(F)(F)F

STK626407
Synonyms: N- cyclopropyl- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (3- methoxyphenyl)- 1,3- oxazol- 5- amine
Smiles: COc1cccc(c1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NC1CC1

STK856789
Synonyms: 2- {2- [3- (4- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]ethyl}- 1H- benzimidazole
Smiles: Clc1ccc(cc1)c1noc(n1)CCc1nc2c([nH]1)cccc2

STK626410
Synonyms: (2Z)- 2- (3,4- dimethoxybenzylidene)- 8- (pyridin- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccccn1

STK626411
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 3- phenyl- 1,2,4- oxadiazole- 5- carboxamide
Smiles: Clc1ccc2c(c1)c(CCNC(=O)c1onc(n1)c1ccccc1)c[nH]2

STK626413
Synonyms: N- (2- {[(4,6- dimethylpyrimidin- 2- yl)sulfanyl]methyl}- 1- methyl- 1H- benzimidazol- 5- yl)furan- 2- carboxamide
Smiles: Cc1cc(C)nc(n1)SCc1nc2c(n1C)ccc(c2)NC(=O)c1ccco1

STK626421
Synonyms: 4- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]butanamide
Smiles: O=C(Nc1ccc(cc1)Cn1cncn1)CCCn1c(O)nc2c(c1=O)cccc2

STK626423
Synonyms: 1- (1H- indol- 2- ylcarbonyl)piperidine- 3- carboxylicacid
Smiles: OC(=O)C1CCCN(C1)C(=O)c1cc2c([nH]1)cccc2

STK626426
Synonyms: 3- ethyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole- 6- thiol
Smiles: CCc1nnc2n1nc(s2)S

STK626427
Synonyms: N- [(2E)- 6- (azepan- 1- ylcarbonyl)- 1,3- benzothiazol- 2(3H)- ylidene]- 4- methoxybenzenesulfonamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c\1/sc2c([nH]1)ccc(c2)C(=O)N1CCCCCC1

STK626428
Synonyms: 5,6- dimethyl- 2- [4- (pyrimidin- 2- yl)piperazin- 1- yl]pyrimidin- 4- ol
Smiles: Cc1nc(nc(c1C)O)N1CCN(CC1)c1ncccn1

STK626430
Synonyms: 5- (1,3- benzodioxol- 5- yl)- 4- (1,3- benzodioxol- 5- ylmethyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1Cc1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2

STK626436
Synonyms: N- [3- cyano- 1- (furan- 2- ylmethyl)- 4,5- dimethyl- 1H- pyrrol- 2- yl]- 2- phenoxyacetamide
Smiles: N#Cc1c(C)c(n(c1NC(=O)COc1ccccc1)Cc1ccco1)C

STK626438
Synonyms: 6- [4- hydroxy- 2- imino- 3- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 1- yl]- 2H- chromen- 2- one
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)c1ccc2c(c1)ccc(=O)o2

STK626441
Synonyms: 1- {[6- (5- bromopyridin- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl]methyl}- 2- methyl- 1H- benzimidazole
Smiles: Brc1cncc(c1)c1nn2c(s1)nnc2Cn1c(C)nc2c1cccc2

STK626443
Synonyms: 5- (2,4- difluorophenyl)- 4- (2,5- dimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1n1c(=S)[nH]nc1c1ccc(cc1F)F)OC

STK626444
Synonyms: 4- [(1E)- 3- (2,4- dimethoxyphenyl)- 3- oxoprop- 1- en- 1- yl]benzoicacid
Smiles: COc1ccc(c(c1)OC)C(=O)/C=C/c1ccc(cc1)C(=O)O

STK626445
Synonyms: 2- {4- [(1Z)- 4- chloro- 1,2- diphenylbut- 1- en- 1- yl]phenoxy}- N,N- dimethylethanamine
Smiles: ClCC/C(=C(\c1ccccc1)/c1ccc(cc1)OCCN(C)C)/c1ccccc1

STK626446
Synonyms: 6- {4- [(2E)- 3- phenylprop- 2- en- 1- yl]piperazin- 1- yl}- 7H- purin- 2- amine
Smiles: Nc1nc(N2CCN(CC2)C/C=C/c2ccccc2)c2c(n1)nc[nH]2

STK626447
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- {(2Z)- 2- [(methylsulfonyl)imino]- 2,3- dihydro- 1,3- thiazol- 4- yl}acetamide
Smiles: COc1cc(CCNC(=O)Cc2cs/c(=N\S(=O)(=O)C)/[nH]2)ccc1OC

STK626450
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- [2- (4- hydroxyphenyl)ethyl]- beta- alaninamide
Smiles: O=C(CCNc1nc(Cl)nc2c1[nH]cn2)NCCc1ccc(cc1)O

STK626452
Synonyms: 3- (4- chlorophenyl)- 9- (pyridin- 2- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Clc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)Cc1ccccn1

STK626456
Synonyms: 3- [(4S)- 1- (1,3- benzodioxol- 5- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]- N- (pyridin- 3- ylmethyl)propanamide
Smiles: O=C(NCc1cccnc1)CC[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2

STK626458
Synonyms: (2Z)- 2- (2- fluorobenzylidene)- 8- (furan- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccccc2F)/Oc2c1ccc1c2CN(CO1)Cc1ccco1

STK626462
Synonyms: 3- [(pyridin- 4- ylmethyl)sulfanyl]- 9H- [1,2,4]triazolo[4,3- a]benzimidazole
Smiles: n1ccc(cc1)CSc1nnc2n1c1ccccc1[nH]2

STK626465
Synonyms: (E)- 1- (4- chlorophenyl)- N- {[8,9- dimethyl- 7- (1,3- thiazol- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}methanimine
Smiles: Clc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1nccs1

STK626466
Synonyms: N- (1- hydroxy- 3- phenylpropan- 2- yl)- 1- (7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: OCC(Cc1ccccc1)NC(=O)C1CCCN(C1)c1ncnc2c1[nH]cn2

STK626467
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- (pyridin- 2- ylmethyl)- beta- alaninamide
Smiles: O=C(NCc1ccccn1)CCNc1nc(Cl)nc2c1[nH]cn2

STK626468
Synonyms: N- (3- methyl- 1,1- dioxidotetrahydrothiophen- 3- yl)- 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]acetamide
Smiles: O=C(NC1(C)CCS(=O)(=O)C1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK626470
Synonyms: N- (2- methoxybenzyl)- N'- (quinolin- 5- yl)ethanediamide
Smiles: COc1ccccc1CNC(=O)C(=O)Nc1cccc2c1cccn2

STK626473
Synonyms: 2- [(5Z)- 5- (3- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2cccc(c2)Cl)/C1=O)Nc1ccc2c(c1)nccn2

STK626474
Synonyms: 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl]- 3- (phenoxymethyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2COc1ccccc1)C

STK626475
Synonyms: 4- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 5- imino- 1- (3- methylbutyl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CC(CCN1CC(=C(C1=N)c1scc(n1)c1ccc(cc1)Cl)O)C

STK626476
Synonyms: 3- [(5Z)- 4- oxo- 5- (quinoxalin- 5- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzoicacid
Smiles: OC(=O)c1cccc(c1)N1C(=S)S/C(=C\c2cccc3c2nccn3)/C1=O

STK626477
Synonyms: (5Z)- 2,6- dihydroxy- 5- ({[2- methyl- 5- (3- methyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl)phenyl]amino}methylidene)pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)/C(=C\Nc2cc(ccc2C)c2sc3n(n2)c(nn3)C)/C(=N1)O

STK626478
Synonyms: 3- hydroxy- N- [(5Z)- 4- oxo- 5- (quinolin- 4- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzamide
Smiles: Oc1cccc(c1)C(=O)NN1C(=S)S/C(=C\c2ccnc3c2cccc3)/C1=O

STK626481
Synonyms: [1- (3,4- diethoxybenzyl)- 6,7- diethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl](3,4,5- trimethoxyphenyl)methanone
Smiles: CCOc1cc2c(cc1OCC)CCN(C2Cc1ccc(c(c1)OCC)OCC)C(=O)c1cc(OC)c(c(c1)OC)OC

STK856793
Synonyms: 2- (naphthalen- 1- yl)- 1- {4- [2- (pyridin- 2- yl)ethyl]piperazin- 1- yl}ethanone
Smiles: O=C(N1CCN(CC1)CCc1ccccn1)Cc1cccc2c1cccc2

STK626483
Synonyms: 3- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (3- methyl- 1,1- dioxidotetrahydrothiophen- 3- yl)propanamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NC1(C)CCS(=O)(=O)C1

STK856794
Synonyms: ethyl2- methyl- 5- [2- oxo- 2- (propan- 2- yloxy)ethoxy]- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(C)oc2c1cc(OCC(=O)OC(C)C)cc2

STK626484
Synonyms: ethyl2- hydroxy- 4- (thiophen- 2- yl)- 3,4- dihydropyrimido[1,2- a]benzimidazole- 3- carboxylate
Smiles: CCOC(=O)C1C(=Nc2n(C1c1cccs1)c1ccccc1n2)O

STK626489
Synonyms: 3- [(5Z)- 5- (furan- 2- ylmethylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- [(3S,4R)- 4- hydroxytetrahydrothiophen- 3- yl]propanamide
Smiles: O=C(N[C@@H]1CSC[C@@H]1O)CCN1C(=O)S/C(=C\c2ccco2)/C1=O

STK626492
Synonyms: N- (2- chlorophenyl)- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)Nc1ccccc1Cl

STK626493
Synonyms: 1- [2- (1H- benzimidazol- 2- yl)pyrrolidin- 1- yl]- 3- phenylpropan- 1- one
Smiles: O=C(N1CCCC1c1nc2c([nH]1)cccc2)CCc1ccccc1

STK626494
Synonyms: 1- [2,5- diamino- 4- (methylsulfanyl)thieno[2,3- d]pyrimidin- 6- yl]ethanone
Smiles: CSc1nc(N)nc2c1c(N)c(s2)C(=O)C

STK626495
Synonyms: N~6~- (3- chloro- 4- fluorophenyl)- 7H- purine- 2,6- diamine
Smiles: Nc1nc(Nc2ccc(c(c2)Cl)F)c2c(n1)nc[nH]2

STK626496
Synonyms: ethyl2- (4- hydroxy- 6- methyl- 2- sulfanylpyrimidin- 5- yl)propanoate
Smiles: CCOC(=O)C(c1c(C)nc(nc1O)S)C

STK626497
Synonyms: (3E)- 3- (3,4- dihydroxybenzylidene)- 1- (4- methoxyphenyl)pyrrolidine- 2,5- dione
Smiles: COc1ccc(cc1)N1C(=O)C/C(=C\c2ccc(c(c2)O)O)/C1=O

STK626499
Synonyms: 3- methoxy- N- [2- (piperidin- 1- ylsulfonyl)ethyl]- N- (pyridin- 4- ylmethyl)benzamide
Smiles: COc1cccc(c1)C(=O)N(Cc1ccncc1)CCS(=O)(=O)N1CCCCC1

STK626500
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]glutamine
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)O)CCC(=O)N

STK626502
Synonyms: N- [(2Z)- 5- acetyl- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]- 5- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2- oxazole- 3- carboxamide
Smiles: O=C(c1noc(c1)c1ccc2c(c1)CCCC2)/N=c/1\sc(c([nH]1)C)C(=O)C

STK626503
Synonyms: methyl{[6- (4- methoxybenzyl)- 5- oxo- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidin- 7- yl]oxy}acetate
Smiles: COC(=O)COc1nc2SCCn2c(=O)c1Cc1ccc(cc1)OC

STK626505
Synonyms: (2Z)- 2- (biphenyl- 4- ylmethylidene)- 7- {[butyl(methyl)ammonio]methyl}- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1ccc(cc1)c1ccccc1)/C2=O)C

STK626510
Synonyms: (2Z)- 2- (2- fluorobenzylidene)- 8- (pyridin- 3- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccccc2F)/Oc2c1ccc1c2CN(CO1)Cc1cccnc1

STK626512
Synonyms: (3Z)- 3- [(6- methoxy- 1H- indol- 3- yl)methylidene]- 2- (pyridin- 3- ylmethyl)- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: COc1ccc2c(c1)[nH]cc2/C=C\1/C(=O)c2ccccc2S(=O)(=O)N1Cc1cccnc1

STK856795
Synonyms: 3- (2- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl2- methylpropanoate
Smiles: COc1ccccc1c1coc2c(c1=O)ccc(c2)OC(=O)C(C)C

STK856796
Synonyms: 2- (3- methoxyphenyl)- 5,6,7,8- tetrahydro- 4H- 1,3- benzoxazine- 4- thione
Smiles: COc1cccc(c1)c1nc(=S)c2c(o1)CCCC2

STK626514
Synonyms: 7- hydroxy- 5- (2- methoxyphenyl)- 3- phenyl- 5,6- dihydro[1,3]thiazolo[4,5- d]pyrimidine- 2(3H)- thione
Smiles: COc1ccccc1C1NC(=c2c(=N1)n(c1ccccc1)c(=S)s2)O

STK626516
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- [2- (1H- indol- 3- yl)ethyl]acetamide
Smiles: O=C(CSc1nc(Cl)nc2c1[nH]cn2)NCCc1c[nH]c2c1cccc2

STK626520
Synonyms: N- [1- (2,4- dichlorobenzyl)- 3,5- dimethyl- 1H- pyrazol- 4- yl]- N'- (pyridin- 4- ylmethyl)ethanediamide
Smiles: Clc1ccc(c(c1)Cl)Cn1nc(c(c1C)NC(=O)C(=O)NCc1ccncc1)C

STK626521
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (3,4- dimethoxyphenyl)- N,N- dimethyl- 1,3- oxazol- 5- amine
Smiles: COc1ccc(cc1OC)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)N(C)C

STK626525
Synonyms: (3R)- N- (2,5- dimethoxyphenyl)- 6,7- dimethoxy- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: COc1ccc(c(c1)NC(=O)[C@H]1N2C(=O)c3c(C2SC1(C)C)ccc(c3OC)OC)OC

STK626526
Synonyms: 4- (1H- indol- 2- ylcarbonyl)- N- {3- oxo- 3- [(2,2,6,6- tetramethylpiperidin- 4- yl)amino]propyl}piperazine- 1- carboxamide
Smiles: O=C(NC1CC(C)(C)NC(C1)(C)C)CCNC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK626528
Synonyms: 7- {2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 2- oxoethoxy}- 2- methyl- 3- phenoxy- 4H- chromen- 4- one
Smiles: OCCN1CCN(CC1)C(=O)COc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C

STK626530
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl3,4- dimethoxybenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)c1ccc(c(c1)OC)OC)cn2C

STK626531
Synonyms: 5- (furan- 2- yl)- 2- hydroxy- 1- (2- methoxyethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COCCn1c(O)nc(=O)c2c1nccc2c1ccco1

STK626532
Synonyms: 3- [(5Z)- 5- benzylidene- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)nccn2)CCN1C(=O)S/C(=C\c2ccccc2)/C1=O

STK626538
Synonyms: 4- hydroxy- 1- [(3- phenyl- 2,1- benzoxazol- 5- yl)carbonyl]- L- proline
Smiles: OC1CN([C@@H](C1)C(=O)O)C(=O)c1ccc2c(c1)c(on2)c1ccccc1

STK626539
Synonyms: methyl4- (5- hydroxy- 3,7,7- trimethyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 4- yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(O)CC(CC2=Nc2c1c(C)no2)(C)C

STK626540
Synonyms: 3- [(4S)- 1- benzyl- 2,5- dioxoimidazolidin- 4- yl]- N- (1,2,3,4- tetrahydronaphthalen- 1- yl)propanamide
Smiles: O=C(NC1CCCc2c1cccc2)CC[C@@H]1NC(=O)N(C1=O)Cc1ccccc1

STK626541
Synonyms: 8- (morpholin- 4- ium- 4- ylmethyl)- 2- oxo- 3- phenyl- 2H- chromen- 7- olate
Smiles: [O-]c1ccc2c(c1C[NH+]1CCOCC1)oc(=O)c(c2)c1ccccc1

STK626544
Synonyms: 4- [4- (2- chlorobenzyl)piperazin- 1- yl]- 7,9- dimethylpyrido[3',2':4,5]furo[3,2- d]pyrimidine
Smiles: Cc1cc(C)c2c(n1)oc1c2ncnc1N1CCN(CC1)Cc1ccccc1Cl

STK626545
Synonyms: propan- 2- yl3- (5- methyl[1,2,4]triazolo[4,3- a]quinolin- 1- yl)propanoate
Smiles: CC(OC(=O)CCc1nnc2n1c1ccccc1c(c2)C)C

STK856799
Synonyms: (2E)- 3- (2,4- dimethoxyphenyl)- 1- (2- hydroxy- 5- methylphenyl)prop- 2- en- 1- one
Smiles: COc1cc(OC)ccc1/C=C/C(=O)c1cc(C)ccc1O

STK626552
Synonyms: N- (2- {[(4- {[2- (1H- imidazol- 5- yl)ethyl]carbamoyl}cyclohexyl)methyl]amino}- 2- oxoethyl)benzamide
Smiles: O=C(CNC(=O)c1ccccc1)NCC1CCC(CC1)C(=O)NCCc1cnc[nH]1

STK626556
Synonyms: 2- (3,4- dimethylphenyl)- 5- (4- methoxyphenyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)c1[nH]n(c(=O)c1)c1ccc(c(c1)C)C

STK626558
Synonyms: (4- ethylpiperazin- 1- yl)(1H- indol- 5- yl)methanone
Smiles: CCN1CCN(CC1)C(=O)c1ccc2c(c1)cc[nH]2

STK626562
Synonyms: 2- [(5E)- 5- (2- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [2- (dimethylamino)ethyl]acetamide
Smiles: CN(CCNC(=O)CN1C(=S)S/C(=C/c2ccccc2Cl)/C1=O)C

STK856801
Synonyms: 3- (1,3- benzoxazol- 2- yl)- 2- oxo- 2H- chromen- 7- yl3- methoxybenzoate
Smiles: COc1cccc(c1)C(=O)Oc1ccc2c(c1)oc(=O)c(c2)c1nc2c(o1)cccc2

STK626565
Synonyms: 2- {[3- (4- chlorophenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}- N- [(2S)- 1- hydroxy- 4- (methylsulfanyl)butan- 2- yl]acetamide
Smiles: CSCC[C@H](NC(=O)COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Cl)C)CO

STK626566
Synonyms: 7- (1,3- benzodioxol- 5- yl)- 3- cyano- 5- methyl- N- phenyl- 1,7- dihydropyrazolo[1,5- a]pyrimidine- 6- carboxamide
Smiles: N#Cc1c[nH]n2c1=NC(=C(C2c1ccc2c(c1)OCO2)C(=O)Nc1ccccc1)C

STK626567
Synonyms: (4E)- 2- (3- chlorophenyl)- 4- ({[3- (1H- imidazol- 1- yl)propyl]amino}methylidene)isoquinoline- 1,3(2H,4H)- dione
Smiles: Clc1cccc(c1)N1C(=O)/C(=C/NCCCn2cncc2)/c2c(C1=O)cccc2

STK626568
Synonyms: ethyl4- [4- (dimethylamino)phenyl]- 2- hydroxy- 3,4- dihydropyrimido[1,2- a]benzimidazole- 3- carboxylate
Smiles: CCOC(=O)C1C(=Nc2n(C1c1ccc(cc1)N(C)C)c1ccccc1n2)O

STK626569
Synonyms: (4E)- 5- (4- ethoxy- 3- methoxyphenyl)- 4- [(4- fluorophenyl)(hydroxy)methylidene]- 1- (5- methyl- 1,2- oxazol- 3- yl)pyrrolidine- 2,3- dione
Smiles: CCOc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1noc(c1)C

STK626572
Synonyms: 7- (5- bromopyridin- 2- yl)- 5,6- dimethyl- N- [3- (morpholin- 4- yl)propyl]- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Brc1ccc(nc1)n1c(C)c(c2c1ncnc2NCCCN1CCOCC1)C

STK626574
Synonyms: 2- [(2,2- dimethyl- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl)oxy]- N- (quinolin- 5- yl)acetamide
Smiles: O=C(Nc1cccc2c1cccn2)COc1ccc2c(c1)OC(CC2=O)(C)C

STK626576
Synonyms: ethyl4- (2- methoxyphenyl)- 2- (4- methylpiperazin- 1- yl)- 6- oxo- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccccc1OC)N1CCN(CC1)C

STK626579
Synonyms: ethyl2- (4- methoxyphenyl)- 5- {[(4- methoxyphenyl)carbonyl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1ccc(cc1)OC)c1ccc(cc1)OC

STK856803
Synonyms: N- [2- (furan- 2- yl)- 2- (morpholin- 4- yl)ethyl]- 2- propoxybenzamide
Smiles: CCCOc1ccccc1C(=O)NCC(c1ccco1)N1CCOCC1

STK626583
Synonyms: 3- (4- chlorophenyl)- 1- (furan- 2- ylmethyl)- 1- (tetrahydrofuran- 2- ylmethyl)urea
Smiles: Clc1ccc(cc1)NC(=O)N(Cc1ccco1)CC1CCCO1

STK626585
Synonyms: N- [2- (3,5- dimethyl- 1H- pyrazol- 1- yl)ethyl]- N'- {2- [(pyridin- 2- ylmethyl)carbamoyl]phenyl}ethanediamide
Smiles: Cc1nn(c(c1)C)CCNC(=O)C(=O)Nc1ccccc1C(=O)NCc1ccccn1

STK626587
Synonyms: 3- (3- benzyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl)- 1H- indole
Smiles: c1ccc(cc1)Cc1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK626588
Synonyms: 3- {[5- (3- chlorophenyl)furan- 2- yl]methyl}- 2- methyl- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: Clc1cccc(c1)c1ccc(o1)CC1C(O)c2ccccc2S(=O)(=O)N1C

STK626589
Synonyms: 1- (1H- indol- 2- ylcarbonyl)- N- (4- methoxyphenyl)piperidine- 3- carboxamide
Smiles: COc1ccc(cc1)NC(=O)C1CCCN(C1)C(=O)c1cc2c([nH]1)cccc2

STK626593
Synonyms: 1- (1H- indol- 3- ylacetyl)- N- (5- methyl- 1,3- thiazol- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)Cc1c[nH]c2c1cccc2)Nc1ncc(s1)C

STK626594
Synonyms: 1- cyclopropyl- 3- {[4- (2,3- dimethylphenyl)piperazin- 1- yl]carbonyl}- 6,7- difluoro- 8- methoxyquinolin- 4(1H)- one
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)N1CCN(CC1)c1cccc(c1C)C)C1CC1

STK626598
Synonyms: (2Z)- 8- (1,3- benzodioxol- 5- ylmethyl)- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc1c2CN(CO1)Cc1ccc2c(c1)OCO2

STK626599
Synonyms: 8- ethyl- 9- methyl- 5- (morpholin- 4- yl)thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: CCc1sc2c(c1C)c1ncnn1c(n2)N1CCOCC1

STK626603
Synonyms: 4- [3- cyano- 5- methyl- 6- (phenylcarbamoyl)- 1,7- dihydropyrazolo[1,5- a]pyrimidin- 7- yl]benzoicacid
Smiles: N#Cc1c[nH]n2c1=NC(=C(C2c1ccc(cc1)C(=O)O)C(=O)Nc1ccccc1)C

STK626605
Synonyms: 1- cyclopropyl- 1- (furan- 2- ylmethyl)- 3- phenylurea
Smiles: O=C(N(C1CC1)Cc1ccco1)Nc1ccccc1

STK626607
Synonyms: (2Z)- 2- (4- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylbenzenesulfonate
Smiles: CCOc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1

STK626608
Synonyms: 3- [2- (4- methoxybenzyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 7- yl]propan- 1- ol
Smiles: OCCCn1c(C)c(c2c1ncn1c2nc(n1)Cc1ccc(cc1)OC)C

STK626611
Synonyms: 1- (1H- indol- 6- ylcarbonyl)- N- [2- (2- methoxyphenyl)ethyl]piperidine- 3- carboxamide
Smiles: COc1ccccc1CCNC(=O)C1CCCN(C1)C(=O)c1ccc2c(c1)[nH]cc2

STK626613
Synonyms: 2- (4- ethylpiperazin- 1- yl)- 6- (2- methoxyphenyl)pyrimidin- 4- ol
Smiles: CCN1CCN(CC1)c1nc(O)cc(n1)c1ccccc1OC

STK626614
Synonyms: N~6~- [2- (4- fluorophenyl)ethyl]- 7H- purine- 2,6- diamine
Smiles: Fc1ccc(cc1)CCNc1nc(N)nc2c1[nH]cn2

STK626615
Synonyms: N- (1H- indol- 5- yl)- 2- oxo- 2- (pyrrolidin- 1- yl)acetamide
Smiles: O=C(C(=O)Nc1ccc2c(c1)cc[nH]2)N1CCCC1

STK626616
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- (3- hydroxypropyl)- beta- alaninamide
Smiles: OCCCNC(=O)CCNc1nc(Cl)nc2c1[nH]cn2

STK626617
Synonyms: ethyl4- (furan- 2- yl)- 6- oxo- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccco1)N1CCN(CC1)c1ccccn1

STK626619
Synonyms: (2S)- {[(2- methyl- 1H- indol- 3- yl)acetyl]amino}(phenyl)ethanoicacid
Smiles: O=C(Cc1c(C)[nH]c2c1cccc2)N[C@@H](c1ccccc1)C(=O)O

STK626620
Synonyms: 4- (3- {(E)- [1- (4- fluorophenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 2,5- dimethyl- 1H- pyrrol- 1- yl)benzoicacid
Smiles: Fc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cc(n(c2C)c2ccc(cc2)C(=O)O)C)/C1=O)O

STK626621
Synonyms: 2- (1,3- dimethyl- 2,4,6- trioxo- 2,3,4,5,6,7- hexahydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl)- N- (5- methyl- 1,3- thiazol- 2- yl)acetamide
Smiles: O=C(CC1C(=O)Nc2c1c(=O)n(c(=O)n2C)C)Nc1ncc(s1)C

STK856804
Synonyms: (2Z)- 3- oxo- 7- (pyrrolidinium- 1- ylmethyl)- 2- (3,4,5- trimethoxybenzylidene)- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc(c3C[NH+]2CCCC2)[O-])cc(c1OC)OC

STK626626
Synonyms: 2- (4- hydroxyphthalazin- 1- yl)- N- [2- (morpholin- 4- yl)- 2- oxoethyl]acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCC(=O)N1CCOCC1

STK626629
Synonyms: trans- 4- ({[(4- chlorophenyl)sulfonyl]amino}methyl)- N- {2- oxo- 2- [(2- phenylethyl)amino]ethyl}cyclohexanecarboxamide
Smiles: O=C(CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)Cl)NCCc1ccccc1

STK626630
Synonyms: N~2~- (2- chloro- 7H- purin- 6- yl)- N- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]glycinamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)CNc1nc(Cl)nc3c1[nH]cn3)c[nH]2

STK626631
Synonyms: N,N- diethyl- 2- [4- imino- 5,6- dimethyl- 7- (pyridin- 4- ylmethyl)- 4,7- dihydro- 3H- pyrrolo[2,3- d]pyrimidin- 3- yl]ethanamine
Smiles: CCN(CCn1cnc2c(c1=N)c(C)c(n2Cc1ccncc1)C)CC

STK626632
Synonyms: 4- ({3- [(5Z)- 5- (2- fluorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]propanoyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(Nc1ccc(c(c1)O)C(=O)O)CCN1C(=O)S/C(=C\c2ccccc2F)/C1=O

STK626634
Synonyms: N- [(2Z)- 1,3- benzothiazol- 2(3H)- ylidene]- 1- [N- (phenylcarbonyl)glycyl]piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)C(=O)CNC(=O)c1ccccc1)/N=c/1\sc2c([nH]1)cccc2

STK626637
Synonyms: 3- (4- methoxyphenyl)- 9- (pyridin- 3- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)Cc1cccnc1

STK626638
Synonyms: N- {3- [5- (acetylamino)- 1- methyl- 1H- benzimidazol- 2- yl]propyl}- 2,3- dihydro- 1,4- benzodioxine- 2- carboxamide
Smiles: CC(=O)Nc1ccc2c(c1)nc(n2C)CCCNC(=O)C1COc2c(O1)cccc2

STK856806
Synonyms: 2- methoxyethyl6- bromo- 2- methyl- 5- [(3- methylbut- 2- en- 1- yl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC=C(C)C)c(c2)Br

STK626639
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- (3,4- dimethoxybenzyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(ccc1OC)Cc1nnc2n1nc(s2)c1cncc(c1)Br

STK626642
Synonyms: 2- {[1- (2,4- difluorophenyl)- 5,5- dioxido- 3a,4,6,6a- tetrahydro- 1H- thieno[3,4- d]imidazol- 2- yl]sulfanyl}- N,N- dimethylacetamide
Smiles: Fc1ccc(c(c1)F)N1C(=NC2C1CS(=O)(=O)C2)SCC(=O)N(C)C

STK626645
Synonyms: N- [3- (1H- benzimidazol- 2- yl)- 1- butyl- 4,5- dimethyl- 1H- pyrrol- 2- yl]- 2- methylpropanamide
Smiles: CCCCn1c(NC(=O)C(C)C)c(c(c1C)C)c1nc2c([nH]1)cccc2

STK626648
Synonyms: N~3~- (diphenylacetyl)- N- [(2S)- 1- hydroxy- 3- methylpentan- 2- yl]- beta- alaninamide
Smiles: CCC([C@H](NC(=O)CCNC(=O)C(c1ccccc1)c1ccccc1)CO)C

STK626652
Synonyms: N~3~- (diphenylacetyl)- N- 1,3- thiazol- 2- yl- beta- alaninamide
Smiles: O=C(Nc1nccs1)CCNC(=O)C(c1ccccc1)c1ccccc1

STK626655
Synonyms: 1- [4- (dimethylamino)phenyl]- 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CN(c1ccc(cc1)N1CC(=C(C1=N)c1sc(c(n1)C)C)O)C

STK626658
Synonyms: trans- 4- ({[(4- fluorophenyl)sulfonyl]amino}methyl)- N- [2- (1H- indol- 3- yl)ethyl]cyclohexanecarboxamide
Smiles: O=C([C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)F)NCCc1c[nH]c2c1cccc2

STK626663
Synonyms: N- (4- acetylphenyl)- 1- [(3,5- dimethyl- 1,2- oxazol- 4- yl)sulfonyl]prolinamide
Smiles: O=C(C1CCCN1S(=O)(=O)c1c(C)noc1C)Nc1ccc(cc1)C(=O)C

STK626668
Synonyms: (5Z)- 5- (4- fluorobenzylidene)- 3- {3- oxo- 3- [2- (pyridin- 3- yl)piperidin- 1- yl]propyl}- 1,3- thiazolidine- 2,4- dione
Smiles: Fc1ccc(cc1)/C=C/1\SC(=O)N(C1=O)CCC(=O)N1CCCCC1c1cccnc1

STK626670
Synonyms: N~6~- (2,5- dimethoxyphenyl)- 7H- purine- 2,6- diamine
Smiles: COc1ccc(cc1Nc1nc(N)nc2c1[nH]cn2)OC

STK626671
Synonyms: 2- chloro- N- (tetrahydrofuran- 2- ylmethyl)- 7H- purin- 6- amine
Smiles: Clc1nc(NCC2CCCO2)c2c(n1)nc[nH]2

STK856808
Synonyms: N- [3- methyl- 2- (phenylcarbonyl)- 1- benzofuran- 5- yl]acetamide
Smiles: CC(=O)Nc1ccc2c(c1)c(C)c(o2)C(=O)c1ccccc1

STK626673
Synonyms: 1- (5- nitropyridin- 2- yl)- N- (pyridin- 2- ylmethyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-])NCc1ccccn1

STK626675
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 2- [(2- methyl- 4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK626679
Synonyms: N- [1- (2,4- dichlorobenzyl)- 3,5- dimethyl- 1H- pyrazol- 4- yl]- N'- [2- (dimethylamino)ethyl]ethanediamide
Smiles: CN(CCNC(=O)C(=O)Nc1c(C)nn(c1C)Cc1ccc(cc1Cl)Cl)C

STK626684
Synonyms: 2- [(2- chlorobenzyl)sulfanyl]- 5- [(pyrimidin- 2- ylsulfanyl)methyl][1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: Clc1ccccc1CSc1nc2n(n1)c(O)cc(n2)CSc1ncccn1

STK626686
Synonyms: (5Z)- 3- (2- fluorophenyl)- 6- hydroxy- 2- thioxo- 5- [(1,2,5- trimethyl- 1H- pyrrol- 3- yl)methylidene]- 2,5- dihydropyrimidin- 4(3H)- one
Smiles: S=C1N=C(O)/C(=C/c2cc(n(c2C)C)C)/C(=O)N1c1ccccc1F

STK626687
Synonyms: ethyl4- (4- chlorophenyl)- 2- hydroxy- 3,4- dihydropyrimido[1,2- a]benzimidazole- 3- carboxylate
Smiles: CCOC(=O)C1C(=Nc2n(C1c1ccc(cc1)Cl)c1ccccc1n2)O

STK856810
Synonyms: 1- (4,6- dimethylpyrimidin- 2- yl)- 4- (3- hydroxyphenyl)- 3- methyl- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: Oc1cccc(c1)C1CC(=Nc2c1c(C)nn2c1nc(C)cc(n1)C)O

STK626688
Synonyms: 1- [2- (morpholin- 4- yl)ethyl]- 1- (naphthalen- 1- ylmethyl)- 3- [4- (propan- 2- yl)phenyl]thiourea
Smiles: S=C(N(Cc1cccc2c1cccc2)CCN1CCOCC1)Nc1ccc(cc1)C(C)C

STK626690
Synonyms: N'- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (3- methoxyphenyl)- 1,3- oxazol- 5- yl]- N,N- dimethylpropane- 1,3- diamine
Smiles: COc1cccc(c1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCCN(C)C

STK856811
Synonyms: (2E)- 1- (2,4- dimethoxyphenyl)- 3- (2,5- dimethoxyphenyl)prop- 2- en- 1- one
Smiles: COc1ccc(c(c1)OC)C(=O)/C=C/c1cc(OC)ccc1OC

STK626694
Synonyms: 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]acetamide
Smiles: O=C(Cn1c(O)nc2c(c1=O)cccc2)Nc1ccc(cc1)Cn1cncn1

STK626696
Synonyms: methyl4- {(Z)- [6- {[(4- chlorophenyl)sulfonyl]oxy}- 3- oxo- 1- benzofuran- 2(3H)- ylidene]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)Cl

STK626697
Synonyms: N- [3- (furan- 2- yl)propyl]- 2- [(4- oxo- 3,4- dihydrospiro[chromene- 2,1'- cyclohexan]- 7- yl)oxy]acetamide
Smiles: O=C(COc1ccc2c(c1)OC1(CC2=O)CCCCC1)NCCCc1ccco1

STK856812
Synonyms: 2- (2- chlorophenyl)- 6- methyl- 2,3- dihydro- 4H- chromen- 4- one
Smiles: Cc1ccc2c(c1)C(=O)CC(O2)c1ccccc1Cl

STK626700
Synonyms: 7,12- dimethyl- 10,11,12,13- tetrahydro[1]benzothieno[3,2- e]bis[1,2,4]triazolo[4,3- a:1',5'- c]pyrimidine
Smiles: CC1CCc2c(C1)c1c3ncnn3c3n(c1s2)c(C)nn3

STK626702
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methylbenzenesulfonate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OS(=O)(=O)c1ccc(cc1)C)cn2C

STK626703
Synonyms: 4- hydroxy- 8- {3- [(2- methoxyphenyl)amino]propyl}- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: COc1ccccc1NCCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK626705
Synonyms: N- (4- chlorophenyl)- 3- cyano- 5- methyl- 7- (pyridin- 3- yl)- 1,7- dihydropyrazolo[1,5- a]pyrimidine- 6- carboxamide
Smiles: N#Cc1c[nH]n2c1=NC(=C(C2c1cccnc1)C(=O)Nc1ccc(cc1)Cl)C

STK626706
Synonyms: ethyl1- {3- [(4S)- 2,5- dioxo- 1- (2- phenylethyl)imidazolidin- 4- yl]propanoyl}piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)C(=O)CC[C@@H]1NC(=O)N(C1=O)CCc1ccccc1

STK626710
Synonyms: (3- phenyl- 2,1- benzoxazol- 5- yl){4- [2- (pyridin- 4- yl)ethyl]piperazin- 1- yl}methanone
Smiles: O=C(c1ccc2c(c1)c(on2)c1ccccc1)N1CCN(CC1)CCc1ccncc1

STK626711
Synonyms: N- (2,5- dimethylphenyl)- 2- [(5- hydroxy- 6- phenyl- 1,2,4- triazin- 3- yl)sulfanyl]acetamide
Smiles: O=C(Nc1cc(C)ccc1C)CSc1nnc(c(n1)O)c1ccccc1

STK626714
Synonyms: 3- {2- [4- (4- fluorophenyl)piperazin- 1- yl]- 2- oxoethyl}- 4,8- dimethyl- 2- oxo- 2H- chromen- 7- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1C)oc(=O)c(c2C)CC(=O)N1CCN(CC1)c1ccc(cc1)F

STK626715
Synonyms: 9- (furan- 2- ylmethyl)- 3- (4- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)Cc1ccco1

STK626717
Synonyms: 2- [2- (3,4- dimethoxyphenyl)- 1,3- thiazol- 4- yl]- N- [2- (1H- imidazol- 4- yl)ethyl]acetamide
Smiles: COc1cc(ccc1OC)c1scc(n1)CC(=O)NCCc1c[nH]cn1

STK626718
Synonyms: 2- [2- (3,4- dimethoxyphenyl)- 1,3- thiazol- 4- yl]- N- (1H- indol- 5- yl)acetamide
Smiles: COc1cc(ccc1OC)c1scc(n1)CC(=O)Nc1ccc2c(c1)cc[nH]2

STK626719
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- (pyrazin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Brc1cncc(c1)c1sc2n(n1)c(nn2)c1nccnc1

STK626722
Synonyms: 3- [3- (thiophen- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: c1csc(c1)c1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK626723
Synonyms: (4E)- 4- [(4- fluorophenyl)(hydroxy)methylidene]- 1- (5- methyl- 1,2- oxazol- 3- yl)- 5- (3,4,5- trimethoxyphenyl)pyrrolidine- 2,3- dione
Smiles: COc1c(OC)cc(cc1OC)C1/C(=C(/c2ccc(cc2)F)\O)/C(=O)C(=O)N1c1noc(c1)C

STK626724
Synonyms: 9- [4- (2- hydroxyethyl)phenyl]- 2- methyl- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: OCCc1ccc(cc1)N1COc2c(C1)c1oc(C)c(c(=O)c1cc2)c1ccccc1

STK856813
Synonyms: (2Z)- 2- (3- bromobenzylidene)- 6- (2- oxopropoxy)- 1- benzofuran- 3(2H)- one
Smiles: CC(=O)COc1ccc2c(c1)O/C(=C\c1cccc(c1)Br)/C2=O

STK856814
Synonyms: (2Z)- 2- (2,5- dimethoxybenzylidene)- 8- (pyridin- 4- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(c(c1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccncc1)OC

STK856815
Synonyms: 6- amino- 4- (1- ethyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)- 3- methyl- 2,4- dihydropyrano[2,3- c]pyrazole- 5- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c(C)nn(c1C)CC)c(C)[nH]n2

STK626726
Synonyms: 3- (4- hydroxy- 2- methylpyrimido[1,2- a]benzimidazol- 3- yl)propanenitrile
Smiles: N#CCCc1c(C)nc2n(c1O)c1ccccc1n2

STK626727
Synonyms: (4Z)- 4- (2,3- dihydro- 1H- indol- 1- ylmethylidene)- 2- (1,1- dioxidotetrahydrothiophen- 3- yl)- 5- methyl- 2,4- dihydro- 3H- pyrazol- 3- one
Smiles: CC1=NN(C(=O)/C/1=C\N1CCc2c1cccc2)C1CCS(=O)(=O)C1

STK626728
Synonyms: N- ({trans- 4- [(3- oxopiperazin- 1- yl)carbonyl]cyclohexyl}methyl)benzenesulfonamide
Smiles: O=C1NCCN(C1)C(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1

STK626729
Synonyms: 3- (4- chlorophenyl)- 2,6- dihydroxy- 5- [5- (4- hydroxyphenyl)- 4,5- dihydro- 1H- pyrazol- 3- yl]pyrimidin- 4(3H)- one
Smiles: Oc1ccc(cc1)C1NN=C(C1)c1c(O)nc(n(c1=O)c1ccc(cc1)Cl)O

STK626730
Synonyms: 6- chloro- N- [3- methyl- 2- (phenylcarbonyl)- 1- benzofuran- 6- yl]pyridine- 3- carboxamide
Smiles: Clc1ccc(cn1)C(=O)Nc1ccc2c(c1)oc(c2C)C(=O)c1ccccc1

STK626731
Synonyms: N- [(4- hydroxyphthalazin- 1- yl)acetyl]glycine
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCC(=O)O

STK626733
Synonyms: 2- chloro- N- (furan- 2- ylmethyl)- 7H- purin- 6- amine
Smiles: Clc1nc(NCc2ccco2)c2c(n1)nc[nH]2

STK626736
Synonyms: (2E)- 7- methyl- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzoate
Smiles: Fc1ccc(cc1)C(=O)Oc1ccc2c(c1C)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK626737
Synonyms: 2- {4- methoxy- 3- [(4- phenylpiperazin- 1- yl)sulfonyl]phenyl}- 4- methyl- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: COc1ccc(cc1S(=O)(=O)N1CCN(CC1)c1ccccc1)N1C(=O)C(CS1(=O)=O)C

STK626738
Synonyms: N- [1- (4- fluorobenzyl)- 1H- pyrazol- 4- yl]- N'- (pyridin- 2- ylmethyl)ethanediamide
Smiles: Fc1ccc(cc1)Cn1ncc(c1)NC(=O)C(=O)NCc1ccccn1

STK626741
Synonyms: 2- (7,8- dimethoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- methylacetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)N(C1CCS(=O)(=O)C1)C

STK626749
Synonyms: N- cyclopropyl- 5- ethyl- 8- oxo- 5,8- dihydro[1,3]dioxolo[4,5- g]quinoline- 7- carboxamide
Smiles: CCn1cc(C(=O)NC2CC2)c(=O)c2c1cc1OCOc1c2

STK626750
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 1- [(4- methoxyphenyl)sulfonyl]piperidine- 4- carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NC1C=CS(=O)(=O)C1

STK626753
Synonyms: 2- [(4- oxo- 3,4- dihydrospiro[chromene- 2,1'- cyclohexan]- 7- yl)oxy]- N- [2- (thiophen- 2- yl)ethyl]acetamide
Smiles: O=C(COc1ccc2c(c1)OC1(CC2=O)CCCCC1)NCCc1cccs1

STK626761
Synonyms: N- (3- methylpyridin- 2- yl)- 2- [(4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1ncccc1C)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK626762
Synonyms: 7- (4- chlorophenyl)- 9- methylpyrimido[5',4':4,5]thieno[3,2- d][1,2,3]triazin- 4- ol
Smiles: Clc1ccc(cc1)c1nc(C)c2c(n1)sc1c2nnnc1O

STK626765
Synonyms: N- cyclopentyl- 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]acetamide
Smiles: O=C(NC1CCCC1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK626770
Synonyms: 6- [2- (3,5- dimethyl- 1- phenyl- 1H- pyrazol- 4- yl)ethyl]- 3- (4- fluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1)c1nnc2n1nc(s2)CCc1c(C)nn(c1C)c1ccccc1

STK626771
Synonyms: 5- (biphenyl- 4- yl)- 2- hydroxy- 1- methylpyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1c(ccn2)c1ccc(cc1)c1ccccc1)C

STK856817
Synonyms: 6- bromo- 2- (3,4- dimethoxyphenyl)- 4H- chromen- 4- one
Smiles: COc1cc(ccc1OC)c1cc(=O)c2c(o1)ccc(c2)Br

STK626776
Synonyms: 5- amino- 4- methyl- 2- phenylthieno[2,3- d]pyrimidine- 6- carboxylicacid
Smiles: OC(=O)c1sc2c(c1N)c(C)nc(n2)c1ccccc1

STK626777
Synonyms: N- cyclopropyl- 2- {[3- (2- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)NC1CC1

STK626782
Synonyms: (2Z)- 2- [(6- bromo- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- [(2- fluorobenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: Brc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCc2ccccc2F)c2c(c1)COCO2

STK626784
Synonyms: N- [(4- nitrophenyl)acetyl]methionine
Smiles: CSCCC(C(=O)O)NC(=O)Cc1ccc(cc1)[N+](=O)[O-]

STK626786
Synonyms: 9- [2- (4- methoxyphenyl)ethyl]- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)CCN1COc2c(C1)c1occ(c(=O)c1cc2)c1ccccc1

STK626789
Synonyms: N- methyl- 2- [2- (morpholin- 4- yl)ethyl]piperidine- 1- carbothioamide
Smiles: CNC(=S)N1CCCCC1CCN1CCOCC1

STK626790
Synonyms: (E)- N- {[8,9- dimethyl- 7- (2- methylpropyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (2- methoxyphenyl)methanimine
Smiles: COc1ccccc1/C=N/OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)CC(C)C

STK856819
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- [(2- methylprop- 2- en- 1- yl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: CC(=C)COc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK626794
Synonyms: N~2~- [3- (1H- benzimidazol- 2- yl)propanoyl]- N- [(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)methyl]- L- alaninamide
Smiles: O=C(N[C@H](C(=O)NCc1cc(=O)n(c(=O)n1C)C)C)CCc1nc2c([nH]1)cccc2

STK626796
Synonyms: 2- {[3- (3,4- dimethoxyphenyl)- 2- oxo- 2H- chromen- 7- yl]oxy}- N- [2- (dimethylamino)ethyl]acetamide
Smiles: COc1cc(ccc1OC)c1cc2ccc(cc2oc1=O)OCC(=O)NCCN(C)C

STK626798
Synonyms: 2- [(4- hydroxypyrimidin- 2- yl)sulfanyl]- 1- [1- (3- methoxyphenyl)- 2,5- dimethyl- 1H- pyrrol- 3- yl]ethanone
Smiles: COc1cccc(c1)n1c(C)cc(c1C)C(=O)CSc1nccc(n1)O

STK626806
Synonyms: 2- [2- (4- benzylpiperazin- 1- yl)- 2- oxoethoxy]- 7,8,9,10- tetrahydroazepino[2,1- b]quinazolin- 12(6H)- one
Smiles: O=C(N1CCN(CC1)Cc1ccccc1)COc1ccc2c(c1)c(=O)n1c(n2)CCCCC1

STK856822
Synonyms: 6- chloro- 5,7- dimethyl- 2H- 1,4- benzoxazin- 3- ol
Smiles: OC1=Nc2c(OC1)cc(c(c2C)Cl)C

STK626808
Synonyms: N- (2- methoxybenzyl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: COc1ccccc1CNC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK626809
Synonyms: 2- [(6- methoxy- 2- methylquinolin- 4- yl)sulfanyl]butanedioicacid
Smiles: Cc1cc(SC(C(=O)O)CC(=O)O)c2c(n1)ccc(c2)OC

STK626812
Synonyms: 9- {2- [3- (thiophen- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]ethyl}- 9H- carbazole
Smiles: c1csc(c1)c1nnc2n1nc(s2)CCn1c2ccccc2c2c1cccc2

STK626813
Synonyms: (2Z)- 2- (2- chlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: Fc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccccc1Cl)/C2=O

STK626815
Synonyms: 5- (4- chlorophenyl)- 2- hydroxypyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Clc1ccc(cc1)c1ccnc2c1c(=O)nc([nH]2)O

STK626816
Synonyms: trans- N- {2- [benzyl(methyl)amino]- 2- oxoethyl}- 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)cyclohexanecarboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)NCC(=O)N(Cc1ccccc1)C

STK626817
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- (1,3- thiazol- 2- yl)- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: O=C(c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1)Nc1nccs1

STK626820
Synonyms: 6- amino- 3,3- dimethyl- 7- (pyridin- 4- ylmethyl)- 8- thioxo- 3,4,7,8- tetrahydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(N)n(Cc2ccncc2)c(=S)c2c1CC(C)(C)OC2

STK626821
Synonyms: (5E)- 3- (2,4- dimethoxyphenyl)- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1cc(OC)ccc1N1C(=S)S/C(=C/c2cnc3c(n2)cccc3)/C1=O

STK626823
Synonyms: (2Z)- 2- (4- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylcyclohexanecarboxylate
Smiles: CCOc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)C1CCCCC1

STK626824
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 3- {(4S)- 1- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 2,5- dioxoimidazolidin- 4- yl}propanamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CC[C@@H]1NC(=O)N(C1=O)CCc1c[nH]c2c1cc(F)cc2

STK626825
Synonyms: N- cyclopentyl- 4- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)benzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)NC2CCCC2)S(=O)(=O)CC1(C)C

STK626826
Synonyms: (5Z)- 5- [(2Z)- 2- chloro- 3- phenylprop- 2- en- 1- ylidene]- 3- {2- [2- (2- hydroxyethyl)piperidin- 1- yl]- 2- oxoethyl}- 1,3- thiazolidine- 2,4- dione
Smiles: OCCC1CCCCN1C(=O)CN1C(=O)S/C(=C\C(=C\c2ccccc2)\Cl)/C1=O

STK626828
Synonyms: [4- (2- fluorophenyl)piperazin- 1- yl]{2- [5- hydroxy- 4- methyl- 4- (propan- 2- yl)- 4H- imidazol- 2- yl]quinolin- 3- yl}methanone
Smiles: CC(C1(C)N=C(N=C1O)c1nc2ccccc2cc1C(=O)N1CCN(CC1)c1ccccc1F)C

STK626829
Synonyms: 1- [3- (1H- indol- 3- yl)propanoyl]- N- [2- (thiophen- 2- yl)ethyl]piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)CCc1c[nH]c2c1cccc2)NCCc1cccs1

STK626831
Synonyms: 6- [2- (3,4- dimethoxyphenyl)ethyl]- 3- (pyrazin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(CCc2nn3c(s2)nnc3c2cnccn2)ccc1OC

STK626834
Synonyms: (2Z)- 8- (2- chloro- 6- fluorobenzyl)- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc1c2CN(CO1)Cc1c(F)cccc1Cl

STK626836
Synonyms: (2Z)- 2- [(6- bromo- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- [(2- methylbenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: Brc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCc2ccccc2C)c2c(c1)COCO2

STK626840
Synonyms: N- (3- carbamoyl- 5,5- dimethyl- 4,7- dihydro- 5H- thieno[2,3- c]pyran- 2- yl)- 4- (cyclopropylcarbonyl)piperazine- 1- carboxamide
Smiles: O=C(N1CCN(CC1)C(=O)C1CC1)Nc1sc2c(c1C(=O)N)CC(OC2)(C)C

STK626841
Synonyms: N- (2- hydroxy- 2- phenylethyl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)NCC(c1ccccc1)O

STK626842
Synonyms: 2- chloro- 6- (1,3,3- trimethyl- 6- azabicyclo[3.2.1]oct- 6- yl)- 7H- purine
Smiles: Clc1nc(N2CC3(CC2CC(C3)(C)C)C)c2c(n1)nc[nH]2

STK856824
Synonyms: N- {2- [(2,5- dimethoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 6- yl}furan- 2- carboxamide
Smiles: COc1ccc(cc1C(=O)c1oc2c(c1C)ccc(c2)NC(=O)c1ccco1)OC

STK626847
Synonyms: N- [2- (3,4- dimethoxyphenyl)ethyl]- 2- (7H- purin- 6- ylsulfanyl)propanamide
Smiles: COc1cc(CCNC(=O)C(Sc2ncnc3c2[nH]cn3)C)ccc1OC

STK626848
Synonyms: 2- {3- [3- (trifluoromethyl)phenyl]- 1,2,4- oxadiazol- 5- yl}pyrazine
Smiles: FC(c1cccc(c1)c1noc(n1)c1cnccn1)(F)F

STK626849
Synonyms: N- (2,6- dimethylphenyl)- 2- [(1- hydroxy- 5- methoxy- 9- oxo- 9H- xanthen- 3- yl)oxy]acetamide
Smiles: COc1cccc2c1oc1cc(OCC(=O)Nc3c(C)cccc3C)cc(c1c2=O)O

STK626851
Synonyms: S- (6- fluoro- 2- methylquinolin- 4- yl)cysteine
Smiles: Cc1cc(SCC(C(=O)O)N)c2c(n1)ccc(c2)F

STK626853
Synonyms: 4- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 1- cycloheptyl- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Clc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)C1CCCCCC1

STK626854
Synonyms: 3- [2- (1,3- benzothiazol- 2- yl)- 5- methyl- 3- oxo- 2,3- dihydro- 1H- pyrazol- 4- yl]- 1- (4- methoxyphenyl)pyrrolidine- 2,5- dione
Smiles: COc1ccc(cc1)N1C(=O)CC(C1=O)c1c(C)[nH]n(c1=O)c1nc2c(s1)cccc2

STK626856
Synonyms: 3,6,6- trimethyl- 4- oxo- N- [2- (thiophen- 2- yl)ethyl]- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1oc2c(c1C)C(=O)CC(C2)(C)C)NCCc1cccs1

STK626864
Synonyms: 2- hydroxy- 6,6- dimethyl- 3- (pyridin- 2- yl)- 3,5,6,8- tetrahydro- 4H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- one
Smiles: Oc1nc2sc3c(c2c(=O)n1c1ccccn1)CC(OC3)(C)C

STK626865
Synonyms: N- [2- (4- hydroxyphenyl)ethyl]- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)NCCc1ccc(cc1)O

STK626868
Synonyms: 2- (3,4- dimethylphenyl)- 5- {[(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1ccc(cc1C)n1[nH]c(cc1=O)CSc1nnnn1c1ccccc1

STK626872
Synonyms: 2- (4- fluorophenyl)- 5- methyl- 4- (3- methylbutyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: CC(CCc1c(C)[nH]n(c1=O)c1ccc(cc1)F)C

STK626875
Synonyms: 2- (4- {(E)- [1- (1,3- benzodioxol- 5- yl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}phenoxy)propanoicacid
Smiles: OC(=O)C(Oc1ccc(cc1)/C=C/1\C(=NC(=O)N(C1=O)c1ccc2c(c1)OCO2)O)C

STK626878
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- (2- fluorophenyl)- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: O=C(c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1)Nc1ccccc1F

STK626879
Synonyms: ethylN- [(1- cyclopropyl- 6,7- difluoro- 8- methoxy- 4- oxo- 1,4- dihydroquinolin- 3- yl)carbonyl]- beta- alaninate
Smiles: CCOC(=O)CCNC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2OC)F)F

STK626882
Synonyms: N- benzyl- 2- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 5,6,7,8- tetrahydro[1]benzothieno[2,3- d]pyrimidin- 4- amine
Smiles: Cc1nn(c(c1)C)c1nc(NCc2ccccc2)c2c(n1)sc1c2CCCC1