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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:04:08 UTC
Update Date2025-03-24 20:35:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01499459
Frequency0.9
Structure
Chemical FormulaC5H7NS
Molecular Mass113.0299
SMILESC1CC2N=C1CS2
InChI KeySAMGVSJEOGCJJL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthianes
Subclass thianes
Direct Parent thianes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylthioethers
  • hydrocarbon derivatives
  • ketimines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrrolines
  • thiazolines
    • Substituents
  • ketimine
  • meta-thiazoline
  • azacycle
  • imine
  • dialkylthioether
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteropolycyclic compound
  • pyrroline
  • thioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • thiane