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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:41 UTC
Update Date2025-03-25 00:50:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180052
Frequency0.5
Structure
Chemical FormulaC8H13NS
Molecular Mass155.0769
SMILESCc1cc(CCN)sc1C
InChI KeyYBLRHJRGFTVSTG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiophenes
Subclass 2,3,5-trisubstituted thiophenes
Direct Parent 2,3,5-trisubstituted thiophenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • 2,3,5-trisubstituted thiophene
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound