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Substance Name: 4H-1,2,4-Triazole, 4,5-bis(4-methylphenyl)-3-((4-chloro-3-methylphenoxy)methyl)-
RN: 141079-06-3
InChIKey: VENINOCWWBMLFO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H22-Cl-N3-O

Molecular Weight

  • 403.9108
 
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Names and Synonyms

Synonyms

  • 4,5-Bis(4-methylphenyl)-3-((4-chloro-3-methylphenoxy)methyl)-4H-1,2,4-triazole
  • BRN 5455584

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 141079-06-3

System Generated Number

  • 0141079063

Structure Descriptors

InChI

1S/C24H22ClN3O/c1-16-4-8-19(9-5-16)24-27-26-23(28(24)20-10-6-17(2)7-11-20)15-29-21-12-13-22(25)18(3)14-21/h4-14H,15H2,1-3H3

InChIKey

VENINOCWWBMLFO-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)c2nnc(n2c3ccc(cc3)C)COc4ccc(c(c4)C)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.