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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:22:30 UTC
Update Date2025-03-24 22:02:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01972599
Frequency0.6
Structure
Chemical FormulaC5H8N2OS
Molecular Mass144.0357
SMILESCn1cccc1S(N)=O
InChI KeyQABDGTSJNJDHCD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrroles
Subclass substituted pyrroles
Direct Parent substituted pyrroles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aminosulfinyl compounds
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-methylpyrroles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfinic acid amides
    • Substituents
  • n-methylpyrrole
  • aromatic heteromonocyclic compound
  • azacycle
  • sulfinic acid derivative
  • heteroaromatic compound
  • sulfinic acid amide
  • substituted pyrrole
  • organosulfur compound
  • aminosulfinyl compound
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound