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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:45 UTC
Update Date2025-03-25 00:56:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02216947
Frequency0.5
Structure
Chemical FormulaC8H10N2O2S2
Molecular Mass230.0184
SMILESCN1CSc2cc(S(N)(=O)=O)ccc21
InChI KeySEMFMZGJWHXRJT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzothiazoles
Subclass benzothiazoles
Direct Parent benzothiazoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkylarylthioethers
  • aminosulfonyl compounds
  • azacyclic compounds
  • benzenoids
  • dialkylarylamines
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfonamides
  • thiazoles
    • Substituents
  • 1,3-benzothiazole
  • organosulfonic acid or derivatives
  • azacycle
  • aminosulfonyl compound
  • alkylarylthioether
  • organosulfur compound
  • aryl thioether
  • organosulfonic acid amide
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organic sulfonic acid or derivatives
  • thioether
  • organonitrogen compound
  • benzo-thiazole
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • dialkylarylamine
  • thiazole