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Substance Name: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(4-fluorophenyl)-
RN: 114058-91-2
InChIKey: YJFTVTOWNFZLSW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H6-F-N3-S

Molecular Weight

  • 195.2204
 
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Names and Synonyms

Synonyms

  • 2,4-Dihydro-5-(4-fluorophenyl)-3H-1,2,4-triazole-3-thione
  • BRN 6647633

Systematic Name

  • 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-(4-fluorophenyl)-

Registry Numbers

CAS Registry Number

  • 114058-91-2

System Generated Number

  • 0114058912

Structure Descriptors

InChI

1S/C8H6FN3S/c9-6-3-1-5(2-4-6)7-10-8(13)12-11-7/h1-4H,(H2,10,11,12,13)

InChIKey

YJFTVTOWNFZLSW-UHFFFAOYSA-N

Smiles

c1cc(ccc1c2[nH][nH]c(=S)n2)F

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.