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CHEBI:38965 - 1-phenyl-1,2-dihydro-3H-1,2,4-triazol-3-one

ChEBI IDCHEBI:38965
ChEBI Name1-phenyl-1,2-dihydro-3H-1,2,4-triazol-3-one
Stars
ASCII Name1-phenyl-1,2-dihydro-3H-1,2,4-triazol-3-one
Last Modified8 May 2013
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC8H7N3O
Net Charge0
Average Mass161.164
Monoisotopic Mass161.05891
SMILESO=c1ncn(-c2ccccc2)n1
InChIInChI=1S/C8H7N3O/c12-8-9-6-11(10-8)7-4-2-1-3-5-7/h1-6H,(H,10,12)
InChIKeyQCDMYEHBRNFUQG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-phenyl-1,2-dihydro-3H-1,2,4-triazol-3-one (CHEBI:38965) has parent hydride 1-phenyl-1H-1,2,4-triazole (CHEBI:38967)
1-phenyl-1,2-dihydro-3H-1,2,4-triazol-3-one (CHEBI:38965) is a triazoles (CHEBI:35727)
1-phenyl-1,2-dihydro-3H-1,2,4-triazol-3-one (CHEBI:38965) is tautomer of 1-phenyl-1H-1,2,4-triazol-3-ol (CHEBI:38966)
Incoming Relation(s)
1-phenyl-1H-1,2,4-triazol-3-ol (CHEBI:38966) is tautomer of 1-phenyl-1,2-dihydro-3H-1,2,4-triazol-3-one (CHEBI:38965)
IUPAC Name 
1-phenyl-1,2-dihydro-3H-1,2,4-triazol-3-one
Registry NumbersSources
Beilstein:130911Beilstein
CAS:4231-68-9ChemIDplus