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Substance Name: 4H-1,2,4-Triazole, 4-methyl-3-(methylthio)-5-(2-thienyl)-
RN: 116850-51-2
InChIKey: GKGGLWHLQWXTQX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H9-N3-S2

Molecular Weight

  • 211.3121
 
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Names and Synonyms

Synonym

  • 4-Methyl-3-(methylthio)-5-(2-thienyl)-4H-1,2,4-triazole

Systematic Name

  • 4H-1,2,4-Triazole, 4-methyl-3-(methylthio)-5-(2-thienyl)-

Registry Numbers

CAS Registry Number

  • 116850-51-2

System Generated Number

  • 0116850512

Structure Descriptors

InChI

1S/C8H9N3S2/c1-11-7(6-4-3-5-13-6)9-10-8(11)12-2/h3-5H,1-2H3

InChIKey

GKGGLWHLQWXTQX-UHFFFAOYSA-N

Smiles

Cn1c(nnc1SC)c2cccs2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 37, Pg. 125, 1994.