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Substance Name: 3H-1,2,4-Triazol-3-one, 1,2-dihydro-2-methyl-5-phenyl-
RN: 54034-38-7
InChIKey: VVUPNBPFNVLLEH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H9-N3-O

Molecular Weight

  • 175.1901
 
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Names and Synonyms

Synonyms

  • 1,2-Dihydro-2-methyl-5-phenyl-3H-1,2,4-triazol-3-one
  • 2-Methyl-5-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one

Systematic Name

  • 3H-1,2,4-Triazol-3-one, 1,2-dihydro-2-methyl-5-phenyl-

Registry Numbers

CAS Registry Number

  • 54034-38-7

System Generated Number

  • 0054034387

Structure Descriptors

InChI

1S/C9H9N3O/c1-12-9(13)10-8(11-12)7-5-3-2-4-6-7/h2-6H,1H3,(H,10,11,13)

InChIKey

VVUPNBPFNVLLEH-UHFFFAOYSA-N

Smiles

Cn1c(=O)nc([nH]1)c2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 33, Pg. 2772, 1990.