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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:33:00 UTC
Update Date2025-03-21 18:45:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00140966
Frequency24.5
Structure
Chemical FormulaC4H8N2S
Molecular Mass116.0408
SMILESNC1=NCCCS1
InChI KeyPQXQEOIFIUJLIE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiazines
Subclass 1,3-thiazines
Direct Parent 1,3-thiazines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • isothioureas
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • meta-thiazine
  • hydrocarbon derivative
  • organic nitrogen compound
  • isothiourea