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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:43 UTC
Update Date2025-03-25 00:54:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205188
Frequency0.5
Structure
Chemical FormulaC13H12N4
Molecular Mass224.1062
SMILESNC1=NC(c2cccnc2)Nc2ccccc21
InChI KeyKZHTZERMCIUUBA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazanaphthalenes
Subclass benzodiazines
Direct Parent quinazolinamines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • amidines
  • azacyclic compounds
  • benzenoids
  • carboximidamides
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyridines and derivatives
  • secondary alkylarylamines
    • Substituents
  • azacycle
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • secondary amine
  • secondary aliphatic/aromatic amine
  • propargyl-type 1,3-dipolar organic compound
  • pyridine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • quinazolinamine
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • imidolactam
  • amine