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U7M

Summary
Name:1-butyl-3-(4-sulfamoylphenyl)urea
Synonyms:4-(3-butylureido)benzenesulfonamide
Formula:C11 H17 N3 O3 S
Formal charge:0
Formula weight:271.336 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71-butyl-3-(4-sulfamoylphenyl)urea

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=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)
InChIKeyInChI1.06KRWAZLNUJVEUNK-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCCNC(=O)Nc1ccc(cc1)[S](N)(=O)=O
SMILESCACTVS3.385CCCCNC(=O)Nc1ccc(cc1)[S](N)(=O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7CCCCNC(=O)Nc1ccc(cc1)S(=O)(=O)N
SMILESOpenEye OEToolkits2.0.7CCCCNC(=O)Nc1ccc(cc1)S(=O)(=O)N

223532

PDB entries from 2024-08-07

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