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Substance Name: 4H-1,2,4-Triazole, 3-(2,4-dichlorophenyl)-5-((4-methylphenoxy)methyl)-4-(4-methylphenyl)-
RN: 141079-03-0
InChIKey: YKVHPAZJXJVAHP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H19-Cl2-N3-O

Molecular Weight

  • 424.3291
 
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Names and Synonyms

Synonyms

  • 3-(2,4-Dichlorophenyl)-5-((4-methylphenoxy)methyl)-4-(4-methylphenyl)-4H-1,2,4-triazole
  • BRN 5457889

Systematic Name

  • 4H-1,2,4-Triazole, 3-(2,4-dichlorophenyl)-5-((4-methylphenoxy)methyl)-4-(4-methylphenyl)-

Registry Numbers

CAS Registry Number

  • 141079-03-0

System Generated Number

  • 0141079030

Structure Descriptors

InChI

1S/C23H19Cl2N3O/c1-15-3-8-18(9-4-15)28-22(14-29-19-10-5-16(2)6-11-19)26-27-23(28)20-12-7-17(24)13-21(20)25/h3-13H,14H2,1-2H3

InChIKey

YKVHPAZJXJVAHP-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)n2c(nnc2c3ccc(cc3Cl)Cl)COc4ccc(cc4)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 31, Pg. 289, 1992.