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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:35 UTC
Update Date2025-03-21 18:02:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00039907
Frequency94.4
Structure
Chemical FormulaC4H12N4O2S
Molecular Mass180.0681
SMILESNC(N)=NCCCS(N)(=O)=O
InChI KeyUBTZVUDSNJNRBL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfonic acids and derivatives
Subclass organic sulfonamides
Direct Parent organic sulfonamides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aminosulfonyl compounds
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • organosulfonamides
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • organosulfonic acid or derivatives
  • aminosulfonyl compound
  • guanidine
  • organic 1,3-dipolar compound
  • carboximidamide
  • organosulfur compound
  • propargyl-type 1,3-dipolar organic compound
  • organosulfonic acid amide
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic sulfonic acid amide