Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:43:14 UTC
Update Date2025-03-24 14:33:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00874066
Frequency1.7
Structure
Chemical FormulaC6H8N2S
Molecular Mass140.0408
SMILESCc1c[nH]c(=S)nc1C
InChI KeyIVYAMTGRPUIBAB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidinethiones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-thiopyrimidines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • pyrimidinethione
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organosulfur compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-thiopyrimidine
  • hydrocarbon derivative
  • organic nitrogen compound
  • thiopyrimidine