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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:41 UTC
Update Date2025-03-25 00:51:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02186937
Frequency0.5
Structure
Chemical FormulaC9H7ClN2O2S
Molecular Mass241.9917
SMILESNS(=O)(=O)c1ccnc2cc(Cl)ccc12
InChI KeyJONFYWVCAKQJHM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass haloquinolines
Direct Parent haloquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • aminosulfonyl compounds
  • aryl chlorides
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfonamides
  • polyhalopyridines
  • pyridinesulfonamides
    • Substituents
  • organosulfonic acid or derivatives
  • polyhalopyridine
  • organochloride
  • pyridine-4-sulfonamide
  • organosulfur compound
  • organohalogen compound
  • organosulfonic acid amide
  • haloquinoline
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • aryl chloride
  • azacycle
  • aminosulfonyl compound
  • heteroaromatic compound
  • aryl halide
  • sulfonyl
  • pyridine
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound