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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:05 UTC
Update Date2025-03-25 00:48:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169483
Frequency0.5
Structure
Chemical FormulaC9H16N2S
Molecular Mass184.1034
SMILESCCCCc1nc(CCN)cs1
InChI KeyCKVCIGASBPCCED-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass thiazoles
Direct Parent 2,4-disubstituted thiazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • 2,4-disubstituted 1,3-thiazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound