Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:21:42 UTC
Update Date2025-03-24 21:35:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01829042
Frequency0.7
Structure
Chemical FormulaC4H6N2S
Molecular Mass114.0252
SMILESCSc1cn[nH]c1
InChI KeyVQRKUUUHFSFKAB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthioethers
Subclass aryl thioethers
Direct Parent aryl thioethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkylarylthioethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrazoles
  • sulfenyl compounds
  • Substituents
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • alkylarylthioether
  • aryl thioether
  • pyrazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • azole