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Substance Name: 4H-1,2,4-Triazole, 3-(2,4-dichlorophenyl)-4-(4-methylphenyl)-5-(phenoxymethyl)-
RN: 141078-95-7
InChIKey: KDEMFGLZHRTUIH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H17-Cl2-N3-O

Molecular Weight

  • 410.3023
 
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Names and Synonyms

Synonyms

  • 3-(2,4-Dichlorophenyl)-4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazole
  • BRN 5455881

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 141078-95-7

System Generated Number

  • 0141078957

Structure Descriptors

InChI

1S/C22H17Cl2N3O/c1-15-7-10-17(11-8-15)27-21(14-28-18-5-3-2-4-6-18)25-26-22(27)19-12-9-16(23)13-20(19)24/h2-13H,14H2,1H3

InChIKey

KDEMFGLZHRTUIH-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)n2c(nnc2c3ccc(cc3Cl)Cl)COc4ccccc4

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.