Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:56:59 UTC
Update Date2025-03-24 19:49:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01050947
Frequency1.3
Structure
Chemical FormulaC7H11NS
Molecular Mass141.0612
SMILESCCc1ccc(CN)s1
InChI KeyYHFOIHQJJZYQHZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiophenes
Subclass 2,5-disubstituted thiophenes
Direct Parent 2,5-disubstituted thiophenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • 2,5-disubstituted thiophene
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound