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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:55 UTC
Update Date2025-03-25 00:54:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205632
Frequency0.5
Structure
Chemical FormulaC11H11N3O2S
Molecular Mass249.0572
SMILESNS(=O)(=O)c1ccc(Nc2cccnc2)cc1
InChI KeyYJQPXJQFVPPMFB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzenesulfonamides
Direct Parent benzenesulfonamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aminosulfonyl compounds
  • azacyclic compounds
  • benzenesulfonyl compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • organosulfonamides
  • pyridines and derivatives
  • secondary amines
  • Substituents
  • organosulfonic acid or derivatives
  • benzenesulfonamide
  • aromatic heteromonocyclic compound
  • azacycle
  • aminosulfonyl compound
  • heteroaromatic compound
  • secondary amine
  • organosulfur compound
  • organosulfonic acid amide
  • organic oxide
  • sulfonyl
  • pyridine
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • amine
  • benzenesulfonyl group