Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:34 UTC
Update Date2025-03-25 00:55:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02214230
Frequency0.5
Structure
Chemical FormulaC8H10N2S
Molecular Mass166.0565
SMILESCN(C)C(=S)c1ccccn1
InChI KeyHFRPORBJWJMRIG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass methylpyridines
Direct Parent methylpyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • carbonyl compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • thioamides
  • thiocarbonyl compounds
  • thiocarboxylic acid amides
  • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • thiocarboxylic acid amide
  • heteroaromatic compound
  • thiocarbonyl group
  • methylpyridine
  • organosulfur compound
  • thioamide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound