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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:33 UTC
Update Date2025-03-25 00:56:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02218794
Frequency0.5
Structure
Chemical FormulaC16H18N2O3S
Molecular Mass318.1038
SMILESCc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccccc2)cc1
InChI KeyLUKFYOVAOBJTDC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass toluenes
Direct Parent n,n-disubstituted p-toluenesulfonamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha amino acids
  • aminosulfonyl compounds
  • anilides
  • benzenesulfonamides
  • benzenesulfonyl compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • organosulfonamides
  • secondary carboxylic acid amides
  • Substituents
  • n,n-disubstituted p-toluenesulfonamide
  • organosulfonic acid or derivatives
  • carbonyl group
  • n-arylamide
  • alpha-amino acid or derivatives
  • organosulfur compound
  • carboxylic acid derivative
  • organosulfonic acid amide
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • benzenesulfonyl group
  • benzenesulfonamide
  • aminosulfonyl compound
  • carboxamide group
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound