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6YP

Summary
Name:4-butylbenzenesulfonamide
Formula:C10 H15 N O2 S
Formal charge:0
Formula weight:213.297 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.54-butylbenzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C10H15NO2S/c1-2-3-4-9-5-7-10(8-6-9)14(11,12)13/h5-8H,2-4H2,1H3,(H2,11,12,13)
InChIKeyInChI1.03IWEMSJAOIKQBBZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCCc1ccc(cc1)[S](N)(=O)=O
SMILESCACTVS3.385CCCCc1ccc(cc1)[S](N)(=O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.5CCCCc1ccc(cc1)S(=O)(=O)N
SMILESOpenEye OEToolkits2.0.5CCCCc1ccc(cc1)S(=O)(=O)N

218853

PDB entries from 2024-04-24

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