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YFH

YFH
Name:	N-({4-[2-(4-{[(4R)-4'-chloro-4-methyl-6-{[4-(4-{[4-{[(2R)-4-[(1R,4R)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]-1-(phenylsulfanyl)butan-2-yl]amino}-3-(trifluoromethanesulfonyl)benzene-1-sulfonyl]carbamoyl}phenyl)piperazin-1-yl]methyl}-2,3,4,5-tetrahydro[1,1'-biphenyl]-4-yl]methyl}piperazin-1-yl)-2-oxoethyl]piperazin-1-yl}acetyl)-3-methyl-L-valyl-(4S)-4-hydroxy-N-{(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl}-L-prolinamide
Formula:	C83 H105 Cl F3 N13 O11 S4
SMILES:	O=S(=O)(c1cc(ccc1NC(CSc1ccccc1)CCN1CC2CC1CO2)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(CC1)CC=1CC(C)(CCC=1c1ccc(Cl)cc1)CN1CCN(CC1)C(=O)CN1CCN(CC1)CC(=O)NC(C(=O)N1CC(O)CC1C(=O)NC(C)c1ccc(cc1)c1scnc1C)C(C)(C)C)C(F)(F)F
InChi:	InChI=1S/C83H105ClF3N13O11S4/c1-55(57-12-14-59(15-13-57)76-56(2)88-54-113-76)89-79(105)72-43-66(101)47-100(72)80(106)77(81(3,4)5)91-74(102)49-94-30-32-95(33-31-94)50-75(103)98-40-36-96(37-41-98)53-82(6)28-26-70(58-16-20-62(84)21-17-58)61(45-82)46-93-34-38-97(39-35-93)64-22-18-60(19-23-64)78(104)92-115(109,110)69-24-25-71(73(44-69)114(107,108)83(85,86)87)90-63(52-112-68-10-8-7-9-11-68)27-29-99-48-67-42-65(99)51-111-67/h7-25,44,54-55,63,65-67,72,77,90,101H,26-43,45-53H2,1-6H3,(H,89,105)(H,91,102)(H,92,104)/t55-,63+,65+,66-,67+,72-,77+,82+/m0/s1
Definition date:	2023-01-26
Last modified:	2024-04-05
Release date:	2024-04-10
Identifier:	N-({4-[2-(4-{[(4R)-4'-chloro-4-methyl-6-{[4-(4-{[4-{[(2R)-4-[(1R,4R)-2-oxa-5-azabicyclo[2.2.1]heptan-5-yl]-1-(phenylsulfanyl)butan-2-yl]amino}-3-(trifluoromethanesulfonyl)benzene-1-sulfonyl]carbamoyl}phenyl)piperazin-1-yl]methyl}-2,3,4,5-tetrahydro[1,1'-biphenyl]-4-yl]methyl}piperazin-1-yl)-2-oxoethyl]piperazin-1-yl}acetyl)-3-methyl-L-valyl-(4S)-4-hydroxy-N-{(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl}-L-prolinamide

ZUJ

ZUJ
Name:	2-[(2-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-N-(4-sulfamoylphenyl)acetamide
Formula:	C17 H16 N2 O6 S
SMILES:	NS(=O)(=O)c1ccc(cc1)NC(=O)COc1ccc2CCC(=O)Oc2c1
InChi:	InChI=1S/C17H16N2O6S/c18-26(22,23)14-6-3-12(4-7-14)19-16(20)10-24-13-5-1-11-2-8-17(21)25-15(11)9-13/h1,3-7,9H,2,8,10H2,(H,19,20)(H2,18,22,23)
Synonyms:	coumarin benzene sulfonamide SG1-51
Definition date:	2023-04-04
Last modified:	2024-03-29
Release date:	2024-04-03
Identifier:	2-[(2-oxo-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-N-(4-sulfamoylphenyl)acetamide

Q2F

Q2F
Name:	~{N}-[[4-[[7-ethyl-2,6-bis(oxidanylidene)purin-3-yl]methyl]cyclohexyl]methyl]-3-fluoranyl-4-(oxan-4-yloxy)benzenesulfonamide
Formula:	C26 H34 F N5 O6 S
SMILES:	CCn1cnc2N(C[CH]3CC[CH](CC3)CN[S](=O)(=O)c4ccc(OC5CCOCC5)c(F)c4)C(=O)NC(=O)c12
InChi:	InChI=1S/C26H34FN5O6S/c1-2-31-16-28-24-23(31)25(33)30-26(34)32(24)15-18-5-3-17(4-6-18)14-29-39(35,36)20-7-8-22(21(27)13-20)38-19-9-11-37-12-10-19/h7-8,13,16-19,29H,2-6,9-12,14-15H2,1H3,(H,30,33,34)/t17-,18-
Definition date:	2022-10-11
Last modified:	2024-03-29
Release date:	2024-04-03
Identifier:	~{N}-[[4-[[7-ethyl-2,6-bis(oxidanylidene)purin-3-yl]methyl]cyclohexyl]methyl]-3-fluoranyl-4-(oxan-4-yloxy)benzenesulfonamide

VMD

VMD
Name:	4-[[1-[3-[[(2~{R})-2-oxidanyl-2-[(4~{S},5~{R})-2,2,5-trimethyl-1,3-dioxolan-4-yl]ethyl]amino]propyl]-1,2,3-triazol-4-yl]methylamino]benzenesulfonamide
Formula:	C20 H32 N6 O5 S
SMILES:	C[CH]1OC(C)(C)O[CH]1[CH](O)CNCCCn2cc(CNc3ccc(cc3)[S](N)(=O)=O)nn2
InChi:	InChI=1S/C20H32N6O5S/c1-14-19(31-20(2,3)30-14)18(27)12-22-9-4-10-26-13-16(24-25-26)11-23-15-5-7-17(8-6-15)32(21,28)29/h5-8,13-14,18-19,22-23,27H,4,9-12H2,1-3H3,(H2,21,28,29)/t14-,18-,19-/m1/s1
Definition date:	2023-03-20
Last modified:	2024-03-22
Release date:	2024-03-27
Identifier:	4-[[1-[3-[[(2~{R})-2-oxidanyl-2-[(4~{S},5~{R})-2,2,5-trimethyl-1,3-dioxolan-4-yl]ethyl]amino]propyl]-1,2,3-triazol-4-yl]methylamino]benzenesulfonamide

VNE

VNE
Name:	(3-methoxyphenyl)-pyrrol-1-yl-methanone
Formula:	C12 H11 N O2
SMILES:	COc1cccc(c1)C(=O)n2cccc2
InChi:	InChI=1S/C12H11NO2/c1-15-11-6-4-5-10(9-11)12(14)13-7-2-3-8-13/h2-9H,1H3
Definition date:	2023-03-20
Last modified:	2024-03-22
Release date:	2024-03-27
Identifier:	(3-methoxyphenyl)-pyrrol-1-yl-methanone

SKU

SKU
Name:	3-[[5-(4-chlorophenyl)-2-methoxycarbonyl-thiophen-3-yl]sulfamoyl]benzenesulfonic acid
Formula:	C18 H14 Cl N O7 S3
SMILES:	COC(=O)c1sc(cc1N[S](=O)(=O)c2cccc(c2)[S](O)(=O)=O)c3ccc(Cl)cc3
InChi:	InChI=1S/C18H14ClNO7S3/c1-27-18(21)17-15(10-16(28-17)11-5-7-12(19)8-6-11)20-29(22,23)13-3-2-4-14(9-13)30(24,25)26/h2-10,20H,1H3,(H,24,25,26)
Definition date:	2023-04-13
Last modified:	2024-03-22
Release date:	2024-03-27
Identifier:	3-[[5-(4-chlorophenyl)-2-methoxycarbonyl-thiophen-3-yl]sulfamoyl]benzenesulfonic acid

WD9

WD9
Name:	2-[(3S)-piperidin-3-yl]oxy-8-propan-2-yl-N-[(2-pyrazol-1-ylphenyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-4-amine
Formula:	C23 H28 N8 O
SMILES:	CC(C)c1cnn2c(NCc3ccccc3n4cccn4)nc(O[CH]5CCCNC5)nc12
InChi:	InChI=1S/C23H28N8O/c1-16(2)19-15-27-31-21(19)28-23(32-18-8-5-10-24-14-18)29-22(31)25-13-17-7-3-4-9-20(17)30-12-6-11-26-30/h3-4,6-7,9,11-12,15-16,18,24H,5,8,10,13-14H2,1-2H3,(H,25,28,29)/t18-/m0/s1
Definition date:	2023-05-12
Last modified:	2024-03-15
Release date:	2024-03-20
Identifier:	2-[(3~{S})-piperidin-3-yl]oxy-8-propan-2-yl-~{N}-[(2-pyrazol-1-ylphenyl)methyl]pyrazolo[1,5-a][1,3,5]triazin-4-amine

V7R

V7R
Name:	4-azanyl-~{N}-(4-oxidanylcyclohexyl)benzenesulfonamide
Formula:	C12 H18 N2 O3 S
SMILES:	Nc1ccc(cc1)[S](=O)(=O)N[CH]2CC[CH](O)CC2
InChi:	InChI=1S/C12H18N2O3S/c13-9-1-7-12(8-2-9)18(16,17)14-10-3-5-11(15)6-4-10/h1-2,7-8,10-11,14-15H,3-6,13H2/t10-,11-
Definition date:	2023-02-24
Last modified:	2024-03-08
Release date:	2024-03-13
Identifier:	4-azanyl-~{N}-(4-oxidanylcyclohexyl)benzenesulfonamide

ZR0

ZR0
Name:	4-bromobenzene-1,3-dicarboxylic acid
Formula:	C8 H5 Br O4
SMILES:	OC(=O)c1cc(ccc1Br)C(=O)O
InChi:	InChI=1S/C8H5BrO4/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3H,(H,10,11)(H,12,13)
Definition date:	2023-07-03
Last modified:	2024-03-01
Release date:	2024-03-06
Identifier:	4-bromobenzene-1,3-dicarboxylic acid

7CQ

7CQ
Name:	5-bromo-2-methoxy-N-(3-(2-oxopyrrolidin-1-yl)phenyl)benzenesulfonamide
Formula:	C17 H17 Br N2 O4 S
SMILES:	Brc1cc(c(OC)cc1)S(=O)(=O)Nc1cccc(c1)N1CCCC1=O
InChi:	InChI=1S/C17H17BrN2O4S/c1-24-15-8-7-12(18)10-16(15)25(22,23)19-13-4-2-5-14(11-13)20-9-3-6-17(20)21/h2,4-5,7-8,10-11,19H,3,6,9H2,1H3
Definition date:	2016-10-04
Last modified:	2024-02-19
Release date:	2017-08-09
Identifier:	5-bromo-2-methoxy-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzene-1-sulfonamide

UE7

UE7
Name:	1-ethyl-3-(4-sulfamoylphenyl)urea
Formula:	C9 H13 N3 O3 S
SMILES:	CCNC(=O)Nc1ccc(cc1)[S](N)(=O)=O
InChi:	InChI=1S/C9H13N3O3S/c1-2-11-9(13)12-7-3-5-8(6-4-7)16(10,14)15/h3-6H,2H2,1H3,(H2,10,14,15)(H2,11,12,13)
Synonyms:	4-(3-ethylureido)benzenesulfonamide
Definition date:	2023-02-02
Last modified:	2024-02-16
Release date:	2024-02-21
Identifier:	1-ethyl-3-(4-sulfamoylphenyl)urea

YPD

YPD
Name:	(2Z)-N-[4-(4-chlorobenzene-1-sulfonyl)phenyl]-2-cyano-3-hydroxy-3-(5-methyl-1,2-oxazol-4-yl)prop-2-enamide
Formula:	C20 H14 Cl N3 O5 S
SMILES:	Cc1oncc1C(/O)=C(C#N)C(=O)Nc1ccc(cc1)S(=O)(=O)c1ccc(Cl)cc1
InChi:	InChI=1S/C20H14ClN3O5S/c1-12-18(11-23-29-12)19(25)17(10-22)20(26)24-14-4-8-16(9-5-14)30(27,28)15-6-2-13(21)3-7-15/h2-9,11,25H,1H3,(H,24,26)/b19-17-
Definition date:	2023-02-15
Last modified:	2024-02-16
Release date:	2024-02-21
Identifier:	(2Z)-N-[4-(4-chlorobenzene-1-sulfonyl)phenyl]-2-cyano-3-hydroxy-3-(5-methyl-1,2-oxazol-4-yl)prop-2-enamide

U7M

U7M
Name:	1-butyl-3-(4-sulfamoylphenyl)urea
Formula:	C11 H17 N3 O3 S
SMILES:	CCCCNC(=O)Nc1ccc(cc1)[S](N)(=O)=O
InChi:	InChI=1S/C11H17N3O3S/c1-2-3-8-13-11(15)14-9-4-6-10(7-5-9)18(12,16)17/h4-7H,2-3,8H2,1H3,(H2,12,16,17)(H2,13,14,15)
Synonyms:	4-(3-butylureido)benzenesulfonamide
Definition date:	2023-01-27
Last modified:	2024-02-16
Release date:	2024-02-21
Identifier:	1-butyl-3-(4-sulfamoylphenyl)urea

WXW

WXW
Name:	(13S,16R,19S)-16-benzyl-43-ethoxy-N-methyl-7,11,14,17-tetraoxo-13-phenyl-5-oxa-2,8,12,15,18-pentaaza-1(1,4),4(1,2)-dibenzena-9(1,4)-cyclohexanacycloicosaphane-19-carboxamide
Formula:	C46 H54 N6 O7
SMILES:	CCOc1cccc2CNc3ccc(C[CH](NC(=O)[CH](Cc4ccccc4)NC(=O)[CH](NC(=O)CC5CCC(CC5)NC(=O)COc12)c6ccccc6)C(=O)NC)cc3
InChi:	InChI=1S/C46H54N6O7/c1-3-58-39-16-10-15-34-28-48-35-21-17-31(18-22-35)26-37(44(55)47-2)50-45(56)38(25-30-11-6-4-7-12-30)51-46(57)42(33-13-8-5-9-14-33)52-40(53)27-32-19-23-36(24-20-32)49-41(54)29-59-43(34)39/h4-18,21-22,32,36-38,42,48H,3,19-20,23-29H2,1-2H3,(H,47,55)(H,49,54)(H,50,56)(H,51,57)(H,52,53)/t32-,36-,37-,38+,42+/m0/s1
Synonyms:	4-O-BETA-METHYL-D-GLUCOPYRANOSYL CELLOBIONOLACTAM OXIME
Definition date:	2023-10-17
Last modified:	2024-02-09
Release date:	2024-02-14

ZTE

ZTE
Name:	N~1~-[(3M)-3-(4-aminothieno[3,2-d]pyrimidin-6-yl)benzene-1-sulfonyl]-L-aspartamide
Formula:	C16 H16 N6 O4 S2
SMILES:	NC(=O)CC(N)C(=O)NS(=O)(=O)c1cccc(c1)c1cc2ncnc(N)c2s1
InChi:	InChI=1S/C16H16N6O4S2/c17-10(5-13(18)23)16(24)22-28(25,26)9-3-1-2-8(4-9)12-6-11-14(27-12)15(19)21-7-20-11/h1-4,6-7,10H,5,17H2,(H2,18,23)(H,22,24)(H2,19,20,21)/t10-/m0/s1
Definition date:	2023-07-04
Last modified:	2024-02-02
Release date:	2024-02-07
Identifier:	N~1~-[(3M)-3-(4-aminothieno[3,2-d]pyrimidin-6-yl)benzene-1-sulfonyl]-L-aspartamide

XH9

XH9
Name:	2-[[4-(5-chloranylpyridin-3-yl)carbonyl-1,4-diazepan-1-yl]methyl]benzenecarbonitrile
Formula:	C19 H19 Cl N4 O
SMILES:	Clc1cncc(c1)C(=O)N2CCCN(CC2)Cc3ccccc3C#N
InChi:	InChI=1S/C19H19ClN4O/c20-18-10-17(12-22-13-18)19(25)24-7-3-6-23(8-9-24)14-16-5-2-1-4-15(16)11-21/h1-2,4-5,10,12-13H,3,6-9,14H2
Definition date:	2023-11-02
Last modified:	2024-02-02
Release date:	2024-02-07
Identifier:	2-[[4-(5-chloranylpyridin-3-yl)carbonyl-1,4-diazepan-1-yl]methyl]benzenecarbonitrile

VWI

VWI
Name:	4-nitrobenzenesulfonic acid
Formula:	C6 H5 N O5 S
SMILES:	O[S](=O)(=O)c1ccc(cc1)[N](=O)=O
InChi:	InChI=1S/C6H5NO5S/c8-7(9)5-1-3-6(4-2-5)13(10,11)12/h1-4H,(H,10,11,12)
Definition date:	2023-04-12
Last modified:	2024-01-19
Release date:	2024-01-24
Identifier:	4-nitrobenzenesulfonic acid

VWT

VWT
Name:	4-cyanobenzenesulfonic acid
Formula:	C7 H5 N O3 S
SMILES:	O[S](=O)(=O)c1ccc(cc1)C#N
InChi:	InChI=1S/C7H5NO3S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-4H,(H,9,10,11)
Definition date:	2023-04-12
Last modified:	2024-01-19
Release date:	2024-01-24
Identifier:	4-cyanobenzenesulfonic acid

VWZ

VWZ
Name:	4-phenylbenzenesulfonic acid
Formula:	C12 H10 O3 S
SMILES:	O[S](=O)(=O)c1ccc(cc1)c2ccccc2
InChi:	InChI=1S/C12H10O3S/c13-16(14,15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H,13,14,15)
Definition date:	2023-04-12
Last modified:	2024-01-19
Release date:	2024-01-24
Identifier:	4-phenylbenzenesulfonic acid

VXC

VXC
Name:	4-bromanylbenzenesulfonic acid
Formula:	C6 H5 Br O3 S
SMILES:	O[S](=O)(=O)c1ccc(Br)cc1
InChi:	InChI=1S/C6H5BrO3S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,(H,8,9,10)
Definition date:	2023-04-12
Last modified:	2024-01-19
Release date:	2024-01-24
Identifier:	4-bromanylbenzenesulfonic acid

VXN

VXN
Name:	4-chloranylbenzenesulfonic acid
Formula:	C6 H5 Cl O3 S
SMILES:	O[S](=O)(=O)c1ccc(Cl)cc1
InChi:	InChI=1S/C6H5ClO3S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,(H,8,9,10)
Definition date:	2023-04-12
Last modified:	2024-01-19
Release date:	2024-01-24
Identifier:	4-chloranylbenzenesulfonic acid

A1ABF

A1ABF
Name:	4-[(pyridin-2-yl)oxy]benzonitrile
Formula:	C12 H8 N2 O
SMILES:	N#Cc1ccc(cc1)Oc1ccccn1
InChi:	InChI=1S/C12H8N2O/c13-9-10-4-6-11(7-5-10)15-12-3-1-2-8-14-12/h1-8H
Definition date:	2024-01-04
Last modified:	2024-01-19
Release date:	2024-01-24
Identifier:	4-[(pyridin-2-yl)oxy]benzonitrile

ZUD

ZUD
Name:	Udenafil
Formula:	C25 H36 N6 O4 S
SMILES:	CN1CCCC1CCNS(=O)(=O)c1cc(C2=NC(=O)c3c(N2)c(nn3C)CCC)c(OCCC)cc1
InChi:	InChI=1S/C25H36N6O4S/c1-5-8-20-22-23(31(4)29-20)25(32)28-24(27-22)19-16-18(10-11-21(19)35-15-6-2)36(33,34)26-13-12-17-9-7-14-30(17)3/h10-11,16-17,26H,5-9,12-15H2,1-4H3,(H,27,28,32)/t17-/m1/s1
Synonyms:	(3P)-3-(1-methyl-7-oxo-3-propyl-4,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-{2-[(2R)-1-methylpyrrolidin-2-yl]ethyl}-4-propoxybenzene-1-sulfonamide
Definition date:	2023-10-06
Last modified:	2024-01-12
Release date:	2024-01-17
Identifier:	(3P)-3-(1-methyl-7-oxo-3-propyl-4,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-{2-[(2R)-1-methylpyrrolidin-2-yl]ethyl}-4-propoxybenzene-1-sulfonamide

WCH

WCH
Name:	(2S,3S,4R,5R)-5-(6-amino-2-((E)-phenyldiazenyl)-9H-purin-9-yl)-N-ethyl-3,4-dihydroxytetrahydrofuran-2-carboxamide
Formula:	C18 H20 N8 O4
SMILES:	CCNC(=O)[CH]1O[CH]([CH](O)[CH]1O)n2cnc3c(N)nc(N=Nc4ccccc4)nc23
InChi:	InChI=1S/C18H20N8O4/c1-2-20-16(29)13-11(27)12(28)17(30-13)26-8-21-10-14(19)22-18(23-15(10)26)25-24-9-6-4-3-5-7-9/h3-8,11-13,17,27-28H,2H2,1H3,(H,20,29)(H2,19,22,23)/b25-24+/t11-,12+,13-,17+/m0/s1
Definition date:	2023-09-26
Last modified:	2024-01-12
Release date:	2024-01-17
Identifier:	(2~{S},3~{S},4~{R},5~{R})-5-[6-azanyl-2-[(~{E})-phenyldiazenyl]purin-9-yl]-~{N}-ethyl-3,4-bis(oxidanyl)oxolane-2-carboxamide

O5L

O5L
Name:	N1-[[4-(4-aminophenyl)sulfanyl-3-(trifluoromethyl)phenyl]methoxy]benzene-1,4-dicarboxamide
Formula:	C22 H18 F3 N3 O3 S
SMILES:	NC(=O)c1ccc(cc1)C(=O)NOCc2ccc(Sc3ccc(N)cc3)c(c2)C(F)(F)F
InChi:	InChI=1S/C22H18F3N3O3S/c23-22(24,25)18-11-13(1-10-19(18)32-17-8-6-16(26)7-9-17)12-31-28-21(30)15-4-2-14(3-5-15)20(27)29/h1-11H,12,26H2,(H2,27,29)(H,28,30)
Definition date:	2023-01-24
Last modified:	2024-01-12
Release date:	2024-01-17
Identifier:	~{N}1-[[4-(4-aminophenyl)sulfanyl-3-(trifluoromethyl)phenyl]methoxy]benzene-1,4-dicarboxamide

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