Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:34:58 UTC
Update Date2025-03-24 17:52:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00998319
Frequency1.4
Structure
Chemical FormulaC7H9NS
Molecular Mass139.0456
SMILESCc1cc(C)[nH]c(=S)c1
InChI KeyZVANSRULPRVUSG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • pyridines and derivatives
  • thiolactams
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • organosulfur compound
  • thiolactam
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound