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Substance Name: 3H-1,2,4-Triazol-3-one, 2,4-dihydro-4-ethyl-2-methyl-5-phenyl-
RN: 947-85-3
InChIKey: AQAZETUOZLTEMY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H13-N3-O

Molecular Weight

  • 203.244
 
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Names and Synonyms

Synonyms

  • 2,4-Dihydro-4-ethyl-2-methyl-5-phenyl-3H-1,2,4-triazol-3-one
  • 5-26-04-00315 (Beilstein Handbook Reference)
  • BRN 0615193

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 947-85-3

System Generated Number

  • 0000947853

Structure Descriptors

InChI

1S/C11H13N3O/c1-3-14-10(12-13(2)11(14)15)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3

InChIKey

AQAZETUOZLTEMY-UHFFFAOYSA-N

Smiles

c1(nn(c(=O)n1CC)C)c1ccccc1

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.