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51E

51E
Name:	3-chloro-5-[6-(5-fluoropyridin-2-yl)pyrimidin-4-yl]benzonitrile
Formula:	C16 H8 Cl F N4
SMILES:	c1c(cc(cc1Cl)C#N)c2ncnc(c2)c3ccc(cn3)F
InChi:	InChI=1S/C16H8ClFN4/c17-12-4-10(7-19)3-11(5-12)15-6-16(22-9-21-15)14-2-1-13(18)8-20-14/h1-6,8-9H
Definition date:	2015-07-09
Last modified:	2015-08-07
Release date:	2015-08-12
Identifier:	3-chloro-5-[6-(5-fluoropyridin-2-yl)pyrimidin-4-yl]benzonitrile

4JJ

4JJ
Name:	4-chlorobenzene-1,2-diamine
Formula:	C6 H7 Cl N2
SMILES:	c1cc(Cl)cc(c1N)N
InChi:	InChI=1S/C6H7ClN2/c7-4-1-2-5(8)6(9)3-4/h1-3H,8-9H2
Definition date:	2015-03-23
Last modified:	2015-08-07
Release date:	2015-08-12
Identifier:	4-chlorobenzene-1,2-diamine

4WA

4WA
Name:	4-[(E)-(4-aminophenyl)diazenyl]benzenesulfonamide
Formula:	C12 H12 N4 O2 S
SMILES:	O=S(=O)(N)c1ccc(cc1)N=Nc2ccc(N)cc2
InChi:	InChI=1S/C12H12N4O2S/c13-9-1-3-10(4-2-9)15-16-11-5-7-12(8-6-11)19(14,17)18/h1-8H,13H2,(H2,14,17,18)/b16-15+
Definition date:	2015-06-11
Last modified:	2015-07-31
Release date:	2015-08-05
Identifier:	4-[(E)-(4-aminophenyl)diazenyl]benzenesulfonamide

4OB

4OB
Name:	N-hydroxy-N'-phenyl-3-(trifluoromethyl)benzenecarboximidamide
Formula:	C14 H11 F3 N2 O
SMILES:	FC(c1cccc(c1)/C(NO)=Nc2ccccc2)(F)F
InChi:	InChI=1S/C14H11F3N2O/c15-14(16,17)11-6-4-5-10(9-11)13(19-20)18-12-7-2-1-3-8-12/h1-9,20H,(H,18,19)
Definition date:	2015-04-27
Last modified:	2015-07-31
Release date:	2015-08-05
Identifier:	N-hydroxy-N'-phenyl-3-(trifluoromethyl)benzenecarboximidamide

4OD

4OD
Name:	N'-(3-bromophenyl)-4-fluoro-N-hydroxy-3-(trifluoromethyl)benzenecarboximidamide
Formula:	C14 H9 Br F4 N2 O
SMILES:	FC(c1c(ccc(c1)/C(NO)=Nc2cc(Br)ccc2)F)(F)F
InChi:	InChI=1S/C14H9BrF4N2O/c15-9-2-1-3-10(7-9)20-13(21-22)8-4-5-12(16)11(6-8)14(17,18)19/h1-7,22H,(H,20,21)
Definition date:	2015-04-27
Last modified:	2015-07-31
Release date:	2015-08-05
Identifier:	N'-(3-bromophenyl)-4-fluoro-N-hydroxy-3-(trifluoromethyl)benzenecarboximidamide

42S

42S
Name:	N'-hydroxy-N-phenyl-3-(trifluoromethyl)benzenecarboximidamide
Formula:	C14 H11 F3 N2 O
SMILES:	FC(F)(F)c2cccc(C(=NO)Nc1ccccc1)c2
InChi:	InChI=1S/C14H11F3N2O/c15-14(16,17)11-6-4-5-10(9-11)13(19-20)18-12-7-2-1-3-8-12/h1-9,20H,(H,18,19)
Definition date:	2015-01-23
Last modified:	2015-07-17
Release date:	2015-07-22
Identifier:	N'-hydroxy-N-phenyl-3-(trifluoromethyl)benzenecarboximidamide

G64

G64
Name:	N-[(2,5-dimethyl-1,3-oxazol-4-yl)methyl]-N'-[(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]-N,5-dimethylbenzene-1,3-dicarboxamide
Formula:	C37 H46 N4 O7 S
SMILES:	c4(ccc(S(=O)(N(CC(O)C(NC(=O)c1cc(C)cc(c1)C(=O)N(C)Cc2nc(oc2C)C)Cc3ccccc3)CC(C)C)=O)cc4)OC
InChi:	InChI=1S/C37H46N4O7S/c1-24(2)21-41(49(45,46)32-15-13-31(47-7)14-16-32)23-35(42)33(19-28-11-9-8-10-12-28)39-36(43)29-17-25(3)18-30(20-29)37(44)40(6)22-34-26(4)48-27(5)38-34/h8-18,20,24,33,35,42H,19,21-23H2,1-7H3,(H,39,43)/t33-,35+/m0/s1
Definition date:	2015-04-28
Last modified:	2015-07-10
Release date:	2015-07-15
Identifier:	N-[(2,5-dimethyl-1,3-oxazol-4-yl)methyl]-N'-[(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]-N,5-dimethylbenzene-1,3-dicarboxamide

VD9

VD9
Name:	4-(propylsulfanyl)benzenesulfonamide
Formula:	C9 H13 N O2 S2
SMILES:	O=S(=O)(c1ccc(SCCC)cc1)N
InChi:	InChI=1S/C9H13NO2S2/c1-2-7-13-8-3-5-9(6-4-8)14(10,11)12/h3-6H,2,7H2,1H3,(H2,10,11,12)
Definition date:	2014-11-10
Last modified:	2015-06-26
Release date:	2015-07-01
Identifier:	4-(propylsulfanyl)benzenesulfonamide

3TV

3TV
Name:	2,3,5,6-tetrafluoro-4-(propylsulfanyl)benzenesulfonamide
Formula:	C9 H9 F4 N O2 S2
SMILES:	O=S(=O)(c1c(F)c(F)c(SCCC)c(F)c1F)N
InChi:	InChI=1S/C9H9F4NO2S2/c1-2-3-17-8-4(10)6(12)9(18(14,15)16)7(13)5(8)11/h2-3H2,1H3,(H2,14,15,16)
Definition date:	2014-10-24
Last modified:	2015-06-26
Release date:	2015-07-01
Identifier:	2,3,5,6-tetrafluoro-4-(propylsulfanyl)benzenesulfonamide

3UF

3UF
Name:	4-[(2-hydroxyethyl)sulfanyl]benzenesulfonamide
Formula:	C8 H11 N O3 S2
SMILES:	O=S(=O)(c1ccc(SCCO)cc1)N
InChi:	InChI=1S/C8H11NO3S2/c9-14(11,12)8-3-1-7(2-4-8)13-6-5-10/h1-4,10H,5-6H2,(H2,9,11,12)
Definition date:	2014-11-03
Last modified:	2015-06-26
Release date:	2015-07-01
Identifier:	4-[(2-hydroxyethyl)sulfanyl]benzenesulfonamide

3UG

3UG
Name:	2,3,5,6-tetrafluoro-4-(piperidin-1-yl)benzenesulfonamide
Formula:	C11 H12 F4 N2 O2 S
SMILES:	O=S(=O)(N)c1c(F)c(F)c(c(F)c1F)N2CCCCC2
InChi:	InChI=1S/C11H12F4N2O2S/c12-6-8(14)11(20(16,18)19)9(15)7(13)10(6)17-4-2-1-3-5-17/h1-5H2,(H2,16,18,19)
Definition date:	2014-11-03
Last modified:	2015-06-26
Release date:	2015-07-01
Identifier:	2,3,5,6-tetrafluoro-4-(piperidin-1-yl)benzenesulfonamide

BNJ

BNJ
Name:	N-cyclopentyl-3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)benzenesulfonamide
Formula:	C14 H16 N2 O3 S2
SMILES:	O=C3SC=C(c1cc(ccc1)S(=O)(=O)NC2CCCC2)N3
InChi:	InChI=1S/C14H16N2O3S2/c17-14-15-13(9-20-14)10-4-3-7-12(8-10)21(18,19)16-11-5-1-2-6-11/h3-4,7-9,11,16H,1-2,5-6H2,(H,15,17)
Definition date:	2014-07-14
Last modified:	2015-06-26
Release date:	2015-07-01
Identifier:	N-cyclopentyl-3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)benzenesulfonamide

BNK

BNK
Name:	2-chloro-N-cyclopentyl-5-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)benzenesulfonamide
Formula:	C14 H15 Cl N2 O3 S2
SMILES:	O=C3SC=C(c1cc(c(Cl)cc1)S(=O)(=O)NC2CCCC2)N3
InChi:	InChI=1S/C14H15ClN2O3S2/c15-11-6-5-9(12-8-21-14(18)16-12)7-13(11)22(19,20)17-10-3-1-2-4-10/h5-8,10,17H,1-4H2,(H,16,18)
Definition date:	2014-07-14
Last modified:	2015-06-26
Release date:	2015-07-01
Identifier:	2-chloro-N-cyclopentyl-5-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)benzenesulfonamide

4A7

4A7
Name:	2,4-dimethoxy-N-(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)benzenesulfonamide
Formula:	C18 H20 N2 O5 S
SMILES:	O=S(=O)(c1ccc(OC)cc1OC)Nc2ccc3c(c2)CCC(=O)N3C
InChi:	InChI=1S/C18H20N2O5S/c1-20-15-7-5-13(10-12(15)4-9-18(20)21)19-26(22,23)17-8-6-14(24-2)11-16(17)25-3/h5-8,10-11,19H,4,9H2,1-3H3
Definition date:	2015-02-19
Last modified:	2015-06-19
Release date:	2015-06-24
Identifier:	2,4-dimethoxy-N-(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)benzenesulfonamide

4A8

4A8
Name:	N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-4-methoxybenzenesulfonamide
Formula:	C16 H17 N3 O4 S
SMILES:	O=S(=O)(c1ccc(OC)cc1)Nc2ccc3c(c2)N(C(=O)N3C)C
InChi:	InChI=1S/C16H17N3O4S/c1-18-14-9-4-11(10-15(14)19(2)16(18)20)17-24(21,22)13-7-5-12(23-3)6-8-13/h4-10,17H,1-3H3
Definition date:	2015-02-19
Last modified:	2015-06-19
Release date:	2015-06-24
Identifier:	N-(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-4-methoxybenzenesulfonamide

4AE

4AE
Name:	N-[6-(4-methoxyphenoxy)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]benzenesulfonamide
Formula:	C22 H21 N3 O5 S
SMILES:	O=S(=O)(c1ccccc1)Nc3cc4c(cc3Oc2ccc(OC)cc2)N(C(=O)N4C)C
InChi:	InChI=1S/C22H21N3O5S/c1-24-19-13-18(23-31(27,28)17-7-5-4-6-8-17)21(14-20(19)25(2)22(24)26)30-16-11-9-15(29-3)10-12-16/h4-14,23H,1-3H3
Definition date:	2015-02-19
Last modified:	2015-06-19
Release date:	2015-06-24
Identifier:	N-[6-(4-methoxyphenoxy)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]benzenesulfonamide

4BJ

4BJ
Name:	N-{6-[3-(benzyloxy)phenoxy]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl}-3,4-dimethoxybenzenesulfonamide
Formula:	C30 H29 N3 O7 S
SMILES:	O=S(=O)(c1cc(OC)c(OC)cc1)Nc4cc5c(cc4Oc3cccc(OCc2ccccc2)c3)N(C(=O)N5C)C
InChi:	InChI=1S/C30H29N3O7S/c1-32-25-17-24(31-41(35,36)23-13-14-27(37-3)29(16-23)38-4)28(18-26(25)33(2)30(32)34)40-22-12-8-11-21(15-22)39-19-20-9-6-5-7-10-20/h5-18,31H,19H2,1-4H3
Definition date:	2015-02-25
Last modified:	2015-06-19
Release date:	2015-06-24
Identifier:	N-{6-[3-(benzyloxy)phenoxy]-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl}-3,4-dimethoxybenzenesulfonamide

4C1

4C1
Name:	N-(6-{3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy}-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-3,4-dimethoxybenzenesulfonamide
Formula:	C32 H42 N4 O8 S
SMILES:	O=S(=O)(c1cc(OC)c(OC)cc1)Nc3cc4c(cc3Oc2cc(OCCC)cc(OCCCCN(C)C)c2)N(C(=O)N4C)C
InChi:	InChI=1S/C32H42N4O8S/c1-8-14-42-22-16-23(43-15-10-9-13-34(2)3)18-24(17-22)44-30-21-28-27(35(4)32(37)36(28)5)20-26(30)33-45(38,39)25-11-12-29(40-6)31(19-25)41-7/h11-12,16-21,33H,8-10,13-15H2,1-7H3
Definition date:	2015-02-25
Last modified:	2015-06-19
Release date:	2015-06-24
Identifier:	N-(6-{3-[4-(dimethylamino)butoxy]-5-propoxyphenoxy}-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)-3,4-dimethoxybenzenesulfonamide

Q1T

Q1T
Name:	3-(2-(6-AMINO-4-METHYLPYRIDIN-2-YL)ETHYL)-5-(METHYL(2-(METHYLAMINO)ETHYL)AMINO)BENZONITRILE
Formula:	C19 H25 N5
SMILES:	CNCCN(C)c1cc(CCc2cc(C)cc(N)n2)cc(c1)C#N
InChi:	InChI=1S/C19H25N5/c1-14-8-17(23-19(21)9-14)5-4-15-10-16(13-20)12-18(11-15)24(3)7-6-22-2/h8-12,22H,4-7H2,1-3H3,(H2,21,23)
Definition date:	2015-03-22
Last modified:	2015-06-19
Release date:	2015-06-24
Identifier:	3-[2-(6-azanyl-4-methyl-pyridin-2-yl)ethyl]-5-[methyl-[2-(methylamino)ethyl]amino]benzenecarbonitrile

JAD

JAD
Name:	2-chloro-4-[(3S,3aS,4S)-4-hydroxy-3-methoxy-3a,4,5,6-tetrahydro-3H-pyrrolo[1,2-b]pyrazol-2-yl]-3-methylbenzonitrile
Formula:	C15 H16 Cl N3 O2
SMILES:	N#Cc3ccc(C2=NN1CCC(O)C1C2OC)c(c3Cl)C
InChi:	InChI=1S/C15H16ClN3O2/c1-8-10(4-3-9(7-17)12(8)16)13-15(21-2)14-11(20)5-6-19(14)18-13/h3-4,11,14-15,20H,5-6H2,1-2H3/t11-,14-,15+/m0/s1
Definition date:	2014-07-04
Last modified:	2015-06-12
Release date:	2015-06-17
Identifier:	2-chloro-4-[(3S,3aS,4S)-4-hydroxy-3-methoxy-3a,4,5,6-tetrahydro-3H-pyrrolo[1,2-b]pyrazol-2-yl]-3-methylbenzonitrile

4QH

4QH
Name:	3,4-dimethoxy-N-[6-(4-methoxyphenoxy)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]benzenesulfonamide
Formula:	C24 H25 N3 O7 S
SMILES:	COc1cc(ccc1OC)S(=O)(Nc3cc2c(N(C(N2C)=O)C)cc3Oc4ccc(OC)cc4)=O
InChi:	InChI=1S/C24H25N3O7S/c1-26-19-13-18(25-35(29,30)17-10-11-21(32-4)23(12-17)33-5)22(14-20(19)27(2)24(26)28)34-16-8-6-15(31-3)7-9-16/h6-14,25H,1-5H3
Definition date:	2015-05-11
Last modified:	2015-06-12
Release date:	2015-06-17
Identifier:	3,4-dimethoxy-N-[6-(4-methoxyphenoxy)-1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl]benzenesulfonamide

4DZ

4DZ
Name:	2-(9-chloro-1H-phenanthro[9,10-d]imidazol-2-yl)benzene-1,3-dicarbonitrile
Formula:	C23 H11 Cl N4
SMILES:	c5ccc(C#N)c(c4nc3c1c(cc(Cl)cc1)c2ccccc2c3n4)c5C#N
InChi:	InChI=1S/C23H11ClN4/c24-15-8-9-18-19(10-15)16-6-1-2-7-17(16)21-22(18)28-23(27-21)20-13(11-25)4-3-5-14(20)12-26/h1-10H,(H,27,28)
Definition date:	2015-03-05
Last modified:	2015-06-05
Release date:	2015-06-10
Identifier:	2-(9-chloro-1H-phenanthro[9,10-d]imidazol-2-yl)benzene-1,3-dicarbonitrile

4RX

4RX
Name:	N-[(4S,4aS,6S,8aR)-10-aminohexahydro-3H-4,8a-(epithiomethenoazeno)isochromen-6(1H)-yl]-3-chlorobenzamide
Formula:	C17 H20 Cl N3 O2 S
SMILES:	C4(NC(c1cccc(c1)Cl)=O)CC2C3COCC2(N=C(S3)N)CC4
InChi:	InChI=1S/C17H20ClN3O2S/c18-11-3-1-2-10(6-11)15(22)20-12-4-5-17-9-23-8-14(13(17)7-12)24-16(19)21-17/h1-3,6,12-14H,4-5,7-9H2,(H2,19,21)(H,20,22)/t12-,13+,14+,17-/m0/s1
Definition date:	2015-05-15
Last modified:	2015-06-05
Release date:	2015-06-10
Identifier:	N-[(4S,4aS,6S,8aR)-10-aminohexahydro-3H-4,8a-(epithiomethenoazeno)isochromen-6(1H)-yl]-3-chlorobenzamide

4EJ

4EJ
Name:	4-[6-(benzylamino)imidazo[1,2-b]pyridazin-3-yl]benzonitrile
Formula:	C20 H15 N5
SMILES:	c1(ccc(cc1)c3n2nc(ccc2nc3)NCc4ccccc4)C#N
InChi:	InChI=1S/C20H15N5/c21-12-15-6-8-17(9-7-15)18-14-23-20-11-10-19(24-25(18)20)22-13-16-4-2-1-3-5-16/h1-11,14H,13H2,(H,22,24)
Definition date:	2015-03-09
Last modified:	2015-05-29
Release date:	2015-06-03
Identifier:	4-[6-(benzylamino)imidazo[1,2-b]pyridazin-3-yl]benzonitrile

4F6

4F6
Name:	4-{6-[(3R)-3-(3-fluorophenyl)morpholin-4-yl]imidazo[1,2-b]pyridazin-3-yl}benzonitrile
Formula:	C23 H18 F N5 O
SMILES:	c5(cc(C4N(c3ccc1n(c(cn1)c2ccc(cc2)C#N)n3)CCOC4)ccc5)F
InChi:	InChI=1S/C23H18FN5O/c24-19-3-1-2-18(12-19)21-15-30-11-10-28(21)23-9-8-22-26-14-20(29(22)27-23)17-6-4-16(13-25)5-7-17/h1-9,12,14,21H,10-11,15H2/t21-/m0/s1
Definition date:	2015-03-16
Last modified:	2015-05-29
Release date:	2015-06-03
Identifier:	4-{6-[(3R)-3-(3-fluorophenyl)morpholin-4-yl]imidazo[1,2-b]pyridazin-3-yl}benzonitrile

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