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Substance Name: 1H-1,2,4-Triazole-3-thiol, 5-(2-pyrazinyl)-
RN: 3458-03-5
InChIKey: PYJDTGAKPZUJRF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H5-N5-S

Molecular Weight

  • 179.206
 
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Names and Synonyms

Synonyms

  • 5-(2-Pyrazinyl)-1H-1,2,4-triazole-3-thiol
  • Pyrazine, 2-(3-mercapto-1H-1,2,4-triazol-5-yl)-

Systematic Name

  • 1H-1,2,4-Triazole-3-thiol, 5-(2-pyrazinyl)-

Registry Numbers

CAS Registry Number

  • 3458-03-5

System Generated Number

  • 0003458035

Structure Descriptors

InChI

1S/C6H5N5S/c12-6-9-5(10-11-6)4-3-7-1-2-8-4/h1-3H,(H2,9,10,11,12)

InChIKey

PYJDTGAKPZUJRF-UHFFFAOYSA-N

Smiles

[nH]1[nH]c(nc1c1cnccn1)=S

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD05 intraperitoneal 780mg/kg (780mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 42, 1966.