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Substance Name: 4H-1,2,4-Triazole, 4-(3-chloro-4-fluorophenyl)-3-(2,4-dichlorophenyl)-5-(phenoxymethyl)-
RN: 141079-15-4
InChIKey: GCVKTJJXEQMGRJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H13-Cl3-F-N3-O

Molecular Weight

  • 448.7107
 
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Names and Synonyms

Synonyms

  • 4-(3-Chloro-4-fluorophenyl)-3-(2,4-dichlorophenyl)-5-(phenoxymethyl)-4H-1,2,4-triazole
  • BRN 5460954

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 141079-15-4

System Generated Number

  • 0141079154

Structure Descriptors

InChI

1S/C21H13Cl3FN3O/c22-13-6-8-16(17(23)10-13)21-27-26-20(12-29-15-4-2-1-3-5-15)28(21)14-7-9-19(25)18(24)11-14/h1-11H,12H2

InChIKey

GCVKTJJXEQMGRJ-UHFFFAOYSA-N

Smiles

c1ccc(cc1)OCc2nnc(n2c3ccc(c(c3)Cl)F)c4ccc(cc4Cl)Cl

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.