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Substance Name: Acetamide, 2-((1-phenyl-5-(4-pyridinyl)-1H-1,3,4-triazol-2-yl)thio)-N-(2,4,6-trimethylphenyl)-
RN: 113518-56-2
InChIKey: DSGWYBZWYKKMQQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H23-N5-O-S

Molecular Weight

  • 429.5457
 
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Names and Synonyms

Synonyms

  • 2-((1-Phenyl-5-(4-pyridinyl)-1H-1,3,4-triazol-2-yl)thio)-N-(2,4,6-trimethylphenyl)acetamide
  • BRN 5169646

Systematic Name

  • Acetamide, 2-((1-phenyl-5-(4-pyridinyl)-1H-1,3,4-triazol-2-yl)thio)-N-(2,4,6-trimethylphenyl)-

Registry Numbers

CAS Registry Number

  • 113518-56-2

System Generated Number

  • 0113518562

Structure Descriptors

InChI

1S/C24H23N5OS/c1-16-13-17(2)22(18(3)14-16)26-21(30)15-31-24-28-27-23(19-9-11-25-12-10-19)29(24)20-7-5-4-6-8-20/h4-14H,15H2,1-3H3,(H,26,30)

InChIKey

DSGWYBZWYKKMQQ-UHFFFAOYSA-N

Smiles

Cc1cc(c(c(c1)C)NC(=O)CSc2nnc(n2c3ccccc3)c4ccncc4)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. 26, Pg. 290, 1987.