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Substance Name: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(4-chlorophenyl)-2-ethyl-4-methyl-
RN: 114058-92-3
InChIKey: HAPBZVDUNLZWPE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H12-Cl-N3-S

Molecular Weight

  • 253.7558
 
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Names and Synonyms

Synonyms

  • 2,4-Dihydro-5-(4-chlorophenyl)-2-ethyl-4-methyl-3H-1,2,4-triazole-3-thione
  • BRN 5045061

Systematic Name

  • 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(4-chlorophenyl)-2-ethyl-4-methyl-

Registry Numbers

CAS Registry Number

  • 114058-92-3

System Generated Number

  • 0114058923

Structure Descriptors

InChI

1S/C11H12ClN3S/c1-3-15-11(16)14(2)10(13-15)8-4-6-9(12)7-5-8/h4-7H,3H2,1-2H3

InChIKey

HAPBZVDUNLZWPE-UHFFFAOYSA-N

Smiles

CCn1c(=S)n(c(n1)c2ccc(cc2)Cl)C

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.