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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:48 UTC
Update Date2025-03-25 00:46:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155377
Frequency0.5
Structure
Chemical FormulaC13H18N2O3S
Molecular Mass282.1038
SMILESCc1ccccc1S(=O)(=O)N1CCC(C(N)=O)CC1
InChI KeyOOLLVJZPWSUXEJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzenesulfonamides
Direct Parent benzenesulfonamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenesulfonyl compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfonamides
  • piperidinecarboxamides
  • piperidines
  • primary carboxylic acid amides
  • sulfonyls
  • toluenes
  • Substituents
  • primary carboxylic acid amide
  • organosulfonic acid or derivatives
  • carbonyl group
  • aromatic heteromonocyclic compound
  • organosulfur compound
  • carboxylic acid derivative
  • organosulfonic acid amide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • piperidine
  • organoheterocyclic compound
  • benzenesulfonyl group
  • benzenesulfonamide
  • azacycle
  • piperidinecarboxamide
  • carboxamide group
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • toluene
  • organooxygen compound