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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:46 UTC
Update Date2025-03-25 00:46:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02152918
Frequency0.5
Structure
Chemical FormulaC7H12N2OS2
Molecular Mass204.0391
SMILESNC(=O)CCSCC1=NCCS1
InChI KeyUUCGTRSDXVXZSY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass thiazolines
Direct Parent thiazolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylthioethers
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • propargyl-type 1,3-dipolar organic compounds
  • sulfenyl compounds
    • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • meta-thiazoline
  • sulfenyl compound
  • azacycle
  • dialkylthioether
  • organic 1,3-dipolar compound
  • organosulfur compound
  • carboxamide group
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • thioether
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound