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Substance Name: Benzeneacetic acid, 4-(5-methyl-4-((phenylamino)carbonyl)-1H-1,2,3-triazol-1-yl)-
RN: 70672-49-0
InChIKey: XCUAUYFPIPTXET-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H16-N4-O3

Molecular Weight

  • 336.3494
 
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Names and Synonyms

Synonyms

  • 4-(5-Methyl-4-((phenylamino)carbonyl)-1H-1,2,3-triazol-1-yl)benzeneacetic acid
  • 5-26-07-00048 (Beilstein Handbook Reference)
  • BRN 0844328

Systematic Name

  • Benzeneacetic acid, 4-(5-methyl-4-((phenylamino)carbonyl)-1H-1,2,3-triazol-1-yl)-

Registry Numbers

CAS Registry Number

  • 70672-49-0

System Generated Number

  • 0070672490

Structure Descriptors

InChI

1S/C18H16N4O3/c1-12-17(18(25)19-14-5-3-2-4-6-14)20-21-22(12)15-9-7-13(8-10-15)11-16(23)24/h2-10H,11H2,1H3,(H,19,25)(H,23,24)

InChIKey

XCUAUYFPIPTXET-UHFFFAOYSA-N

Smiles

Cc1c(nnn1c2ccc(cc2)CC(=O)O)C(=O)Nc3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 800mg/kg (800mg/kg)   Farmaco, Edizione Scientifica. Vol. 34, Pg. 371, 1979.