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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:44 UTC
Update Date2025-03-21 18:38:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00119397
Frequency21.8
Structure
Chemical FormulaC8H12N4O2S2
Molecular Mass260.0402
SMILESCC(SCc1csc(N=C(N)N)n1)C(=O)O
InChI KeyFKPPLEVTGUSLDQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass thiazoles
Direct Parent 2,4-disubstituted thiazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • dialkylthioethers
  • guanidines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • sulfenyl compounds
    • Substituents
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • guanidine
  • organosulfur compound
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • sulfenyl compound
  • azacycle
  • dialkylthioether
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioether
  • 2,4-disubstituted 1,3-thiazole
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound