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Substance Name: 4H-1,2,4-Triazole, 4-ethyl-3-(2-fluorophenyl)-5-(methylthio)-
RN: 116850-64-7
InChIKey: ABJXTKLEFREOEP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H12-F-N3-S

Molecular Weight

  • 237.3008
 
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Names and Synonyms

Synonym

  • 4-Ethyl-3-(2-fluorophenyl)-5-(methylthio)-4H-1,2,4-triazole

Systematic Name

  • 4H-1,2,4-Triazole, 4-ethyl-3-(2-fluorophenyl)-5-(methylthio)-

Registry Numbers

CAS Registry Number

  • 116850-64-7

System Generated Number

  • 0116850647

Structure Descriptors

InChI

1S/C11H12FN3S/c1-3-15-10(13-14-11(15)16-2)8-6-4-5-7-9(8)12/h4-7H,3H2,1-2H3

InChIKey

ABJXTKLEFREOEP-UHFFFAOYSA-N

Smiles

CCn1c(nnc1SC)c2ccccc2F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 37, Pg. 125, 1994.