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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:17:08 UTC
Update Date2025-03-25 00:59:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02240389
Frequency0.5
Structure
Chemical FormulaC16H21N3O2S
Molecular Mass319.1354
SMILESNC(Cc1ccccc1)C(=O)CCC1SCC2NC(=O)NC21
InChI KeyANUCIRRDTCKPQA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenethylamines
Direct Parent amphetamines and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzene and substituted derivatives
  • dialkylthioethers
  • hydrocarbon derivatives
  • imidazolidinones
  • ketones
  • monoalkylamines
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • thienoimidazolidines
  • thiolanes
  • thiophenes
  • Substituents
  • thiolane
  • imidazolidine
  • carbonyl group
  • thiophene
  • ketone
  • imidazolidinone
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • amphetamine or derivatives
  • carbonic acid derivative
  • azacycle
  • dialkylthioether
  • thienoimidazolidine
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound