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Substance Name: 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-dimethyl-5-(4-methylphenyl)-
RN: 117258-24-9
InChIKey: WFWCOSSCUIGFMC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H13-N3-O

Molecular Weight

  • 203.2437
 
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Names and Synonyms

Synonyms

  • 2,4-Dihydro-2,4-dimethyl-5-(4-methylphenyl)-3H-1,2,4-triazol-3-one
  • BRN 4187308

Systematic Name

  • 3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-dimethyl-5-(4-methylphenyl)-

Registry Numbers

CAS Registry Number

  • 117258-24-9

System Generated Number

  • 0117258249

Structure Descriptors

InChI

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

InChIKey

WFWCOSSCUIGFMC-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)c2nn(c(=O)n2C)C

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.