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VYV

Summary
Name:4-[({2-[(phenylcarbamoyl)amino]ethyl}sulfonyl)amino]benzene-1-sulfonamide
Formula:C15 H18 N4 O5 S2
Formal charge:0
Formula weight:398.457 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-[({2-[(phenylcarbamoyl)amino]ethyl}sulfonyl)amino]benzene-1-sulfonamide
OpenEye OEToolkits2.0.71-phenyl-3-[2-[(4-sulfamoylphenyl)sulfamoyl]ethyl]urea

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1ccccc1NC(NCCS(Nc2ccc(cc2)S(=O)(=O)N)(=O)=O)=O
InChIInChI1.03InChI=1S/C15H18N4O5S2/c16-26(23,24)14-8-6-13(7-9-14)19-25(21,22)11-10-17-15(20)18-12-4-2-1-3-5-12/h1-9,19H,10-11H2,(H2,16,23,24)(H2,17,18,20)
InChIKeyInChI1.03JWGFBEXNOWIWRP-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385N[S](=O)(=O)c1ccc(N[S](=O)(=O)CCNC(=O)Nc2ccccc2)cc1
SMILESCACTVS3.385N[S](=O)(=O)c1ccc(N[S](=O)(=O)CCNC(=O)Nc2ccccc2)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)NC(=O)NCCS(=O)(=O)Nc2ccc(cc2)S(=O)(=O)N
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)NC(=O)NCCS(=O)(=O)Nc2ccc(cc2)S(=O)(=O)N

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건을2024-07-10부터공개중

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