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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:14 UTC
Update Date2025-03-25 00:56:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220414
Frequency0.5
Structure
Chemical FormulaC15H13NOS
Molecular Mass255.0718
SMILESCOC1=Nc2ccccc2SC1c1ccccc1
InChI KeyLPIVOIAAUZFHED-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzothiazines
Subclass benzothiazines
Direct Parent benzothiazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,4-thiazines
  • alkylarylthioethers
  • azacyclic compounds
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • imidolactones
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • monocyclic benzene moiety
  • para-thiazine
  • azacycle
  • benzothiazine
  • organic 1,3-dipolar compound
  • alkylarylthioether
  • aryl thioether
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • thioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • imidolactone
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound