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Substance Name: 1H-1,2,4-Triazole, 3-(3-fluorophenyl)-4-methyl-5-(methylthio)-
RN: 144165-20-8
InChIKey: IDJLCZSOBSQVFH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H10-F-N3-S

Molecular Weight

  • 223.274
 
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Names and Synonyms

Synonym

  • 5-(3-Fluorophenyl)-4-methyl-5-(methylthio)-4H-1,2,4-triazole

Systematic Names

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

Registry Numbers

CAS Registry Number

  • 144165-20-8

System Generated Number

  • 0144165208

Structure Descriptors

InChI

1S/C10H10FN3S/c1-14-9(12-13-10(14)15-2)7-4-3-5-8(11)6-7/h3-6H,1-2H3

InChIKey

IDJLCZSOBSQVFH-UHFFFAOYSA-N

Smiles

Cn1c(nnc1SC)c2cccc(c2)F

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.