Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:10:06 UTC
Update Date2025-03-24 21:30:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01801358
Frequency0.7
Structure
Chemical FormulaC5H7N3S
Molecular Mass141.0361
SMILESCn1c(N)ccnc1=S
InChI KeyMCRNXSFNUQWYOS-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
  • organopnictogen compounds
  • organosulfur compounds
  • primary amines
  • Substituents
  • pyrimidinethione
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organosulfur compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-thiopyrimidine
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • thiopyrimidine