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6LU

Summary
Name:4-{[(3,5-dimethylphenyl)carbamoyl]amino}benzene-1-sulfonamide
Formula:C15 H17 N3 O3 S
Formal charge:0
Formula weight:319.379 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-{[(3,5-dimethylphenyl)carbamoyl]amino}benzene-1-sulfonamide
OpenEye OEToolkits2.0.41-(3,5-dimethylphenyl)-3-(4-sulfamoylphenyl)urea

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Cc1cc(cc(c1)C)NC(=O)Nc2ccc(S(=O)(=O)N)cc2
InChIInChI1.03InChI=1S/C15H17N3O3S/c1-10-7-11(2)9-13(8-10)18-15(19)17-12-3-5-14(6-4-12)22(16,20)21/h3-9H,1-2H3,(H2,16,20,21)(H2,17,18,19)
InChIKeyInChI1.03SPEYBQKWONGMOH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Cc1cc(C)cc(NC(=O)Nc2ccc(cc2)[S](N)(=O)=O)c1
SMILESCACTVS3.385Cc1cc(C)cc(NC(=O)Nc2ccc(cc2)[S](N)(=O)=O)c1
SMILES_CANONICALOpenEye OEToolkits2.0.4Cc1cc(cc(c1)NC(=O)Nc2ccc(cc2)S(=O)(=O)N)C
SMILESOpenEye OEToolkits2.0.4Cc1cc(cc(c1)NC(=O)Nc2ccc(cc2)S(=O)(=O)N)C

221051

PDB entries from 2024-06-12

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