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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:35 UTC
Update Date2025-03-25 00:46:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154873
Frequency0.5
Structure
Chemical FormulaC11H16N2OS
Molecular Mass224.0983
SMILESCC(=O)N1CCC(c2scnc2C)CC1
InChI KeyGINYJEOCXWDWKU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpiperidines
Subclass n-acylpiperidines
Direct Parent n-acylpiperidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 4,5-disubstituted thiazoles
  • acetamides
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
    • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • carboxylic acid derivative
  • 4,5-disubstituted 1,3-thiazole
  • n-acyl-piperidine
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • thiazole
  • acetamide
  • organooxygen compound
  • azole