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X7W

X7W
Name:	5-chloro-4-({(1S,2S,4S)-2-(dimethylamino)-4-[3-(trifluoromethyl)phenyl]cyclohexyl}amino)-2-fluoro-N-(pyrimidin-4-yl)benzene-1-sulfonamide
Formula:	C25 H26 Cl F4 N5 O2 S
SMILES:	O=S(=O)(Nc1ccncn1)c1cc(Cl)c(NC2CCC(CC2N(C)C)c2cccc(c2)C(F)(F)F)cc1F
InChi:	InChI=1S/C25H26ClF4N5O2S/c1-35(2)22-11-16(15-4-3-5-17(10-15)25(28,29)30)6-7-20(22)33-21-13-19(27)23(12-18(21)26)38(36,37)34-24-8-9-31-14-32-24/h3-5,8-10,12-14,16,20,22,33H,6-7,11H2,1-2H3,(H,31,32,34)/t16-,20-,22-/m0/s1
Definition date:	2022-11-04
Last modified:	2023-04-07
Release date:	2023-04-12
Identifier:	5-chloro-4-({(1S,2S,4S)-2-(dimethylamino)-4-[3-(trifluoromethyl)phenyl]cyclohexyl}amino)-2-fluoro-N-(pyrimidin-4-yl)benzene-1-sulfonamide

X80

X80
Name:	5-chloro-4-(cyclopentylmethoxy)-N-(4-{[(1S,2S)-2-(dimethylamino)cyclohexyl]amino}-2-fluorobenzene-1-sulfonyl)-2-fluorobenzamide
Formula:	C27 H34 Cl F2 N3 O4 S
SMILES:	CN(C)C1CCCCC1Nc1ccc(c(F)c1)S(=O)(=O)NC(=O)c1cc(Cl)c(OCC2CCCC2)cc1F
InChi:	InChI=1S/C27H34ClF2N3O4S/c1-33(2)24-10-6-5-9-23(24)31-18-11-12-26(22(30)13-18)38(35,36)32-27(34)19-14-20(28)25(15-21(19)29)37-16-17-7-3-4-8-17/h11-15,17,23-24,31H,3-10,16H2,1-2H3,(H,32,34)/t23-,24-/m0/s1
Definition date:	2022-11-04
Last modified:	2023-04-07
Release date:	2023-04-12
Identifier:	5-chloro-4-(cyclopentylmethoxy)-N-(4-{[(1S,2S)-2-(dimethylamino)cyclohexyl]amino}-2-fluorobenzene-1-sulfonyl)-2-fluorobenzamide

OYH

OYH
Name:	4-{[(4S)-2,7-diphenylimidazo[1,2-a]pyridin-3-yl]amino}benzene-1,2-dicarboxylic acid
Formula:	C27 H19 N3 O4
SMILES:	O=C(O)c1cc(ccc1C(=O)O)Nc1c(nc2cc(ccn12)c1ccccc1)c1ccccc1
InChi:	InChI=1S/C27H19N3O4/c31-26(32)21-12-11-20(16-22(21)27(33)34)28-25-24(18-9-5-2-6-10-18)29-23-15-19(13-14-30(23)25)17-7-3-1-4-8-17/h1-16,28H,(H,31,32)(H,33,34)
Definition date:	2022-05-19
Last modified:	2023-04-07
Release date:	2023-04-12
Identifier:	4-{[(4S)-2,7-diphenylimidazo[1,2-a]pyridin-3-yl]amino}benzene-1,2-dicarboxylic acid

OYR

OYR
Name:	4-({(4R)-7-phenyl-2-[4-(2-{[4-(pyridin-2-yl)phenyl]methoxy}ethyl)phenyl]imidazo[1,2-a]pyridin-3-yl}amino)benzene-1,2-dicarboxylic acid
Formula:	C41 H32 N4 O5
SMILES:	O=C(O)c1cc(ccc1C(=O)O)Nc1c(nc2cc(ccn12)c1ccccc1)c1ccc(CCOCc2ccc(cc2)c2ccccn2)cc1
InChi:	InChI=1S/C41H32N4O5/c46-40(47)34-18-17-33(25-35(34)41(48)49)43-39-38(44-37-24-32(19-22-45(37)39)29-6-2-1-3-7-29)31-15-9-27(10-16-31)20-23-50-26-28-11-13-30(14-12-28)36-8-4-5-21-42-36/h1-19,21-22,24-25,43H,20,23,26H2,(H,46,47)(H,48,49)
Definition date:	2022-05-19
Last modified:	2023-04-07
Release date:	2023-04-12
Identifier:	4-({(4R)-7-phenyl-2-[4-(2-{[4-(pyridin-2-yl)phenyl]methoxy}ethyl)phenyl]imidazo[1,2-a]pyridin-3-yl}amino)benzene-1,2-dicarboxylic acid

XXF

XXF
Name:	(3P)-3-[6-chloro-4-(9-methyl-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile
Formula:	C22 H23 Cl N6 O
SMILES:	N#Cc1cccc(c1)c1c2c([NH]c1Cl)ncnc2N1CC2(CCN(C)CC2)OCC1
InChi:	InChI=1S/C22H23ClN6O/c1-28-7-5-22(6-8-28)13-29(9-10-30-22)21-18-17(16-4-2-3-15(11-16)12-24)19(23)27-20(18)25-14-26-21/h2-4,11,14H,5-10,13H2,1H3,(H,25,26,27)
Definition date:	2022-12-14
Last modified:	2023-03-31
Release date:	2023-04-05
Identifier:	(3P)-3-[6-chloro-4-(9-methyl-1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile

Y3I

Y3I
Name:	(3P)-3-{4-[(3R,5S)-3-amino-5-methylpiperidin-1-yl]-6-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl}benzonitrile
Formula:	C19 H19 Cl N6
SMILES:	N#Cc1cccc(c1)c1c2c(ncnc2[NH]c1Cl)N1CC(C)CC(N)C1
InChi:	InChI=1S/C19H19ClN6/c1-11-5-14(22)9-26(8-11)19-16-15(13-4-2-3-12(6-13)7-21)17(20)25-18(16)23-10-24-19/h2-4,6,10-11,14H,5,8-9,22H2,1H3,(H,23,24,25)/t11-,14+/m0/s1
Definition date:	2023-01-03
Last modified:	2023-03-31
Release date:	2023-04-05
Identifier:	(3P)-3-{4-[(3R,5S)-3-amino-5-methylpiperidin-1-yl]-6-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl}benzonitrile

Y3O

Y3O
Name:	(3P)-3-{4-[(2S,5R)-5-amino-2-methylpiperidin-1-yl]-6-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl}benzonitrile
Formula:	C19 H19 Cl N6
SMILES:	N#Cc1cccc(c1)c1c2c(ncnc2[NH]c1Cl)N1CC(N)CCC1C
InChi:	InChI=1S/C19H19ClN6/c1-11-5-6-14(22)9-26(11)19-16-15(13-4-2-3-12(7-13)8-21)17(20)25-18(16)23-10-24-19/h2-4,7,10-11,14H,5-6,9,22H2,1H3,(H,23,24,25)/t11-,14+/m0/s1
Definition date:	2023-01-03
Last modified:	2023-03-31
Release date:	2023-04-05
Identifier:	(3P)-3-{4-[(2S,5R)-5-amino-2-methylpiperidin-1-yl]-6-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl}benzonitrile

QQ0

QQ0
Name:	4-methanoyl-~{N}-methyl-~{N}-(2-sulfanylethyl)benzenesulfonamide
Formula:	C10 H13 N O3 S2
SMILES:	CN(CCS)[S](=O)(=O)c1ccc(C=O)cc1
InChi:	InChI=1S/C10H13NO3S2/c1-11(6-7-15)16(13,14)10-4-2-9(8-12)3-5-10/h2-5,8,15H,6-7H2,1H3
Definition date:	2022-11-10
Last modified:	2023-03-24
Release date:	2023-03-29
Identifier:	4-methanoyl-~{N}-methyl-~{N}-(2-sulfanylethyl)benzenesulfonamide

OE3

OE3
Name:	~{N}-[(1-ethyl-4-methyl-2-oxidanylidene-quinolin-6-yl)methyl]benzenesulfonamide
Formula:	C19 H20 N2 O3 S
SMILES:	CCN1C(=O)C=C(C)c2cc(CN[S](=O)(=O)c3ccccc3)ccc12
InChi:	InChI=1S/C19H20N2O3S/c1-3-21-18-10-9-15(12-17(18)14(2)11-19(21)22)13-20-25(23,24)16-7-5-4-6-8-16/h4-12,20H,3,13H2,1-2H3
Definition date:	2022-09-06
Last modified:	2023-03-17
Release date:	2023-03-22
Identifier:	~{N}-[(1-ethyl-4-methyl-2-oxidanylidene-quinolin-6-yl)methyl]benzenesulfonamide

WQB

WQB
Name:	N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-N-hexylbenzenesulfonamide
Formula:	C21 H23 F6 N O3 S
SMILES:	O=S(=O)(N(CCCCCC)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)c1ccccc1
InChi:	InChI=1S/C21H23F6NO3S/c1-2-3-4-8-15-28(32(30,31)18-9-6-5-7-10-18)17-13-11-16(12-14-17)19(29,20(22,23)24)21(25,26)27/h5-7,9-14,29H,2-4,8,15H2,1H3
Definition date:	2022-10-12
Last modified:	2023-03-10
Release date:	2023-03-15
Identifier:	N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-N-hexylbenzenesulfonamide

Y5B

Y5B
Name:	N-[([1,1'-biphenyl]-4-yl)methyl]-N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]benzenesulfonamide
Formula:	C28 H21 F6 N O3 S
SMILES:	O=S(=O)(N(Cc1ccc(cc1)c1ccccc1)c1ccc(cc1)C(O)(C(F)(F)F)C(F)(F)F)c1ccccc1
InChi:	InChI=1S/C28H21F6NO3S/c29-27(30,31)26(36,28(32,33)34)23-15-17-24(18-16-23)35(39(37,38)25-9-5-2-6-10-25)19-20-11-13-22(14-12-20)21-7-3-1-4-8-21/h1-18,36H,19H2
Definition date:	2023-01-05
Last modified:	2023-03-10
Release date:	2023-03-15
Identifier:	N-[([1,1'-biphenyl]-4-yl)methyl]-N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]benzenesulfonamide

LE8

LE8
Name:	2-chloro-4-({5-[(2,6-difluorophenyl)methyl]-1,3-oxazol-2-yl}amino)benzonitrile
Formula:	C17 H10 Cl F2 N3 O
SMILES:	Fc1cccc(F)c1Cc1cnc(Nc2cc(Cl)c(C#N)cc2)o1
InChi:	InChI=1S/C17H10ClF2N3O/c18-14-6-11(5-4-10(14)8-21)23-17-22-9-12(24-17)7-13-15(19)2-1-3-16(13)20/h1-6,9H,7H2,(H,22,23)
Definition date:	2022-03-04
Last modified:	2023-03-10
Release date:	2023-03-15
Identifier:	2-chloro-4-({5-[(2,6-difluorophenyl)methyl]-1,3-oxazol-2-yl}amino)benzonitrile

M63

M63
Name:	(6S,9R,19S,22R)-N-{[4-(aminomethyl)phenyl]methyl}-22-[(3-chlorobenzene-1-sulfonyl)amino]-3,12,21-trioxo-2,6,9,13,20-pentaazatetracyclo[22.2.2.2~6,9~.2~14,17~]dotriaconta-1(26),14,16,24,27,29-hexaene-19-carboxamide
Formula:	C42 H49 Cl N8 O6 S
SMILES:	NCc1ccc(cc1)CNC(=O)C1Cc2ccc(NC(=O)CCN3CCN(CCC(=O)Nc4ccc(CC(NS(=O)(=O)c5cccc(Cl)c5)C(=O)N1)cc4)CC3)cc2
InChi:	InChI=1S/C42H49ClN8O6S/c43-33-2-1-3-36(26-33)58(56,57)49-38-25-30-10-14-35(15-11-30)47-40(53)17-19-51-22-20-50(21-23-51)18-16-39(52)46-34-12-8-29(9-13-34)24-37(48-42(38)55)41(54)45-28-32-6-4-31(27-44)5-7-32/h1-15,26,37-38,49H,16-25,27-28,44H2,(H,45,54)(H,46,52)(H,47,53)(H,48,55)/t37-,38+/m0/s1
Definition date:	2022-03-14
Last modified:	2023-03-10
Release date:	2023-03-15
Identifier:	(6S,9R,19S,22R)-N-{[4-(aminomethyl)phenyl]methyl}-22-[(3-chlorobenzene-1-sulfonyl)amino]-3,12,21-trioxo-2,6,9,13,20-pentaazatetracyclo[22.2.2.2~6,9~.2~14,17~]dotriaconta-1(26),14,16,24,27,29-hexaene-19-carboxamide

NZR

NZR
Name:	(2M)-4'-methyl-2-(2H-tetrazol-5-yl)[1,1'-biphenyl]-3-sulfonamide
Formula:	C14 H13 N5 O2 S
SMILES:	Cc1ccc(cc1)c1cccc(c1c1n[NH]nn1)S(N)(=O)=O
InChi:	InChI=1S/C14H13N5O2S/c1-9-5-7-10(8-6-9)11-3-2-4-12(22(15,20)21)13(11)14-16-18-19-17-14/h2-8H,1H3,(H2,15,20,21)(H,16,17,18,19)
Definition date:	2022-04-14
Last modified:	2023-03-03
Release date:	2023-03-08
Identifier:	(2M)-4'-methyl-2-(2H-tetrazol-5-yl)[1,1'-biphenyl]-3-sulfonamide

O0F

O0F
Name:	(6P)-4-amino-6-(2H-tetrazol-5-yl)benzene-1,3-disulfonamide
Formula:	C7 H9 N7 O4 S2
SMILES:	NS(=O)(=O)c1cc(c(cc1N)c1n[NH]nn1)S(N)(=O)=O
InChi:	InChI=1S/C7H9N7O4S2/c8-4-1-3(7-11-13-14-12-7)5(19(9,15)16)2-6(4)20(10,17)18/h1-2H,8H2,(H2,9,15,16)(H2,10,17,18)(H,11,12,13,14)
Definition date:	2022-04-14
Last modified:	2023-03-03
Release date:	2023-03-08
Identifier:	(6P)-4-amino-6-(2H-tetrazol-5-yl)benzene-1,3-disulfonamide

UKR

UKR
Name:	1-{[(3S,4S)-3-({4-[2-(4-fluorobenzene-1-sulfonyl)ethyl]piperidin-1-yl}methyl)-4-(3-fluorophenyl)pyrrolidin-1-yl]methyl}cyclopentane-1-carboxylic acid
Formula:	C31 H40 F2 N2 O4 S
SMILES:	Fc1ccc(cc1)S(=O)(=O)CCC1CCN(CC1)CC1CN(CC2(CCCC2)C(=O)O)CC1c1cccc(F)c1
InChi:	InChI=1S/C31H40F2N2O4S/c32-26-6-8-28(9-7-26)40(38,39)17-12-23-10-15-34(16-11-23)19-25-20-35(22-31(30(36)37)13-1-2-14-31)21-29(25)24-4-3-5-27(33)18-24/h3-9,18,23,25,29H,1-2,10-17,19-22H2,(H,36,37)/t25-,29+/m0/s1
Definition date:	2022-08-22
Last modified:	2023-03-03
Release date:	2023-03-08
Identifier:	1-{[(3S,4S)-3-({4-[2-(4-fluorobenzene-1-sulfonyl)ethyl]piperidin-1-yl}methyl)-4-(3-fluorophenyl)pyrrolidin-1-yl]methyl}cyclopentane-1-carboxylic acid

Q8Z

Q8Z
Name:	~{N}-methoxy-~{N}-methyl-benzenesulfonamide
Formula:	C8 H11 N O3 S
SMILES:	CON(C)[S](=O)(=O)c1ccccc1
InChi:	InChI=1S/C8H11NO3S/c1-9(12-2)13(10,11)8-6-4-3-5-7-8/h3-7H,1-2H3
Definition date:	2022-10-17
Last modified:	2023-03-03
Release date:	2023-03-08
Identifier:	~{N}-methoxy-~{N}-methyl-benzenesulfonamide

Q96

Q96
Name:	3-azanyl-~{N}-methyl-4-(methylamino)benzenesulfonamide
Formula:	C8 H13 N3 O2 S
SMILES:	CNc1ccc(cc1N)[S](=O)(=O)NC
InChi:	InChI=1S/C8H13N3O2S/c1-10-8-4-3-6(5-7(8)9)14(12,13)11-2/h3-5,10-11H,9H2,1-2H3
Definition date:	2022-10-17
Last modified:	2023-03-03
Release date:	2023-03-08
Identifier:	3-azanyl-~{N}-methyl-4-(methylamino)benzenesulfonamide

Q9I

Q9I
Name:	4-chloranyl-~{N}-methoxy-~{N}-methyl-benzenesulfonamide
Formula:	C8 H10 Cl N O3 S
SMILES:	CON(C)[S](=O)(=O)c1ccc(Cl)cc1
InChi:	InChI=1S/C8H10ClNO3S/c1-10(13-2)14(11,12)8-5-3-7(9)4-6-8/h3-6H,1-2H3
Definition date:	2022-10-17
Last modified:	2023-03-03
Release date:	2023-03-08
Identifier:	4-chloranyl-~{N}-methoxy-~{N}-methyl-benzenesulfonamide

QAU

QAU
Name:	3-oxidanylbenzenesulfonamide
Formula:	C6 H7 N O3 S
SMILES:	N[S](=O)(=O)c1cccc(O)c1
InChi:	InChI=1S/C6H7NO3S/c7-11(9,10)6-3-1-2-5(8)4-6/h1-4,8H,(H2,7,9,10)
Definition date:	2022-10-17
Last modified:	2023-03-03
Release date:	2023-03-08
Identifier:	3-oxidanylbenzenesulfonamide

QB6

QB6
Name:	3-azanyl-4-oxidanyl-benzenesulfonamide
Formula:	C6 H8 N2 O3 S
SMILES:	Nc1cc(ccc1O)[S](N)(=O)=O
InChi:	InChI=1S/C6H8N2O3S/c7-5-3-4(12(8,10)11)1-2-6(5)9/h1-3,9H,7H2,(H2,8,10,11)
Definition date:	2022-10-17
Last modified:	2023-03-03
Release date:	2023-03-08
Identifier:	3-azanyl-4-oxidanyl-benzenesulfonamide

XNR

XNR
Name:	N-(3-{[(3S)-4-(cyclopentanecarbonyl)-3-methylpiperazin-1-yl]methyl}-5-fluoro-2-methylphenyl)-4-fluorobenzene-1-sulfonamide
Formula:	C25 H31 F2 N3 O3 S
SMILES:	Fc1ccc(cc1)S(=O)(=O)Nc1cc(F)cc(CN2CC(C)N(CC2)C(=O)C2CCCC2)c1C
InChi:	InChI=1S/C25H31F2N3O3S/c1-17-15-29(11-12-30(17)25(31)19-5-3-4-6-19)16-20-13-22(27)14-24(18(20)2)28-34(32,33)23-9-7-21(26)8-10-23/h7-10,13-14,17,19,28H,3-6,11-12,15-16H2,1-2H3/t17-/m0/s1
Definition date:	2022-11-30
Last modified:	2023-02-24
Release date:	2023-03-01
Identifier:	N-(3-{[(3S)-4-(cyclopentanecarbonyl)-3-methylpiperazin-1-yl]methyl}-5-fluoro-2-methylphenyl)-4-fluorobenzene-1-sulfonamide

WQZ

WQZ
Name:	(3P)-3-(5,6-dihydro-1,4-dioxin-2-yl)-5-{[(3-{[(2R,3R,4R,5S)-3,4,5-trihydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl}phenyl)methyl]amino}benzonitrile
Formula:	C25 H29 N3 O6
SMILES:	OCC1C(O)C(O)C(O)CN1Cc1cccc(c1)CNc1cc(cc(C#N)c1)C1=COCCO1
InChi:	InChI=1S/C25H29N3O6/c26-10-18-7-19(23-15-33-4-5-34-23)9-20(8-18)27-11-16-2-1-3-17(6-16)12-28-13-22(30)25(32)24(31)21(28)14-29/h1-3,6-9,15,21-22,24-25,27,29-32H,4-5,11-14H2/t21-,22+,24-,25-/m1/s1
Definition date:	2022-10-14
Last modified:	2023-02-17
Release date:	2023-02-22
Identifier:	(3P)-3-(5,6-dihydro-1,4-dioxin-2-yl)-5-{[(3-{[(2R,3R,4R,5S)-3,4,5-trihydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl}phenyl)methyl]amino}benzonitrile

WFB

WFB
Name:	4,4'-(1H-benzimidazole-2,6-diyl)di(benzene-1-carboximidamide)
Formula:	C21 H18 N6
SMILES:	N=C(N)c1ccc(cc1)c1ccc2nc([NH]c2c1)c1ccc(cc1)C(=N)N
InChi:	InChI=1S/C21H18N6/c22-19(23)13-3-1-12(2-4-13)16-9-10-17-18(11-16)27-21(26-17)15-7-5-14(6-8-15)20(24)25/h1-11H,(H3,22,23)(H3,24,25)(H,26,27)
Definition date:	2022-09-06
Last modified:	2023-02-17
Release date:	2023-02-22
Identifier:	4,4'-(1H-benzimidazole-2,6-diyl)di(benzene-1-carboximidamide)

884

884
Name:	4,4'-(1H-indole-2,6-diyl)dibenzenecarboximidamide
Formula:	C22 H19 N5
SMILES:	[N@H]=C(N)c4ccc(c1ccc2c(c1)nc(c2)c3ccc(C(=[N@H])N)cc3)cc4
InChi:	InChI=1S/C22H19N5/c23-21(24)15-5-1-13(2-6-15)17-9-10-18-12-19(27-20(18)11-17)14-3-7-16(8-4-14)22(25)26/h1-12,27H,(H3,23,24)(H3,25,26)
Definition date:	2011-04-26
Last modified:	2023-02-17
Release date:	2023-02-22
Identifier:	4,4'-(1H-indole-2,6-diyl)dibenzenecarboximidamide

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