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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:02 UTC
Update Date2025-03-25 00:50:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178618
Frequency0.5
Structure
Chemical FormulaC14H14ClNO2S
Molecular Mass295.0434
SMILESCc1cccc(C)c1NS(=O)(=O)c1ccccc1Cl
InChI KeyAVYMFNILTIXEJO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass sulfanilides
Direct Parent sulfanilides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aminosulfonyl compounds
  • aryl chlorides
  • benzenesulfonamides
  • benzenesulfonyl compounds
  • chlorobenzenes
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfonamides
  • m-xylenes
  • Substituents
  • organosulfonic acid or derivatives
  • organochloride
  • organosulfur compound
  • organohalogen compound
  • organosulfonic acid amide
  • xylene
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • benzenesulfonyl group
  • aryl chloride
  • chlorobenzene
  • benzenesulfonamide
  • aminosulfonyl compound
  • m-xylene
  • aryl halide
  • aromatic homomonocyclic compound
  • sulfanilide
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • halobenzene