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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:03 UTC
Update Date2025-03-25 01:01:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251830
Frequency0.5
Structure
Chemical FormulaC6H12N2O2S
Molecular Mass176.0619
SMILESO=S1(=O)CC2CCCN2CN1
InChI KeyQNNXVNBDTPMFRH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiadiazinanes
Subclass thiadiazinanes
Direct Parent thiadiazinanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organic oxides
  • organic sulfonamides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfonamides
    • Substituents
  • thiadiazinane
  • organosulfonic acid or derivatives
  • azacycle
  • n-alkylpyrrolidine
  • organosulfonic acid amide
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • organic sulfonic acid amide