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Substance Name: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-ethyl-2-methyl-5-phenyl-
RN: 114058-89-8
InChIKey: ADEUINFOYLGADE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H13-N3-S

Molecular Weight

  • 219.3107
 
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Names and Synonyms

Synonyms

  • 2,4-Dihydro-4-ethyl-2-methyl-5-phenyl-3H-1,2,4-triazole-3-thione
  • BRN 6725191

Systematic Name

  • 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-ethyl-2-methyl-5-phenyl-

Registry Numbers

CAS Registry Number

  • 114058-89-8

System Generated Number

  • 0114058898

Structure Descriptors

InChI

1S/C11H13N3S/c1-3-14-10(12-13(2)11(14)15)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3

InChIKey

ADEUINFOYLGADE-UHFFFAOYSA-N

Smiles

CCn1c(nn(c1=S)C)c2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 31, Pg. 1253, 1988.