1H-1,2,4-Triazole-3-thiol, 5-(3-pyridyl)-, hydrochloride

CAS 4923-16-4 MFCD01678550

化学结构图

4923-16-4
SMILES: Cl.Sc1n[nH]c(-c2cccnc2)n1

化学属性

Mol. FormulaC7H6N4S.ClH
Mol. Weight214.69

别名和识别编码

Chemical Name1H-1,2,4-Triazole-3-thiol, 5-(3-pyridyl)-, hydrochloride
Wiswesser Line NotationT6NJ C- ET5MN DNJ CSH &GH
Synonym 5-(3-Pyridyl)-1H-1,2,4-triazole-3-thiol hydrochloride
CAS Number4923-16-4
InChIKeyBYRNIPJCQGDFEL-UHFFFAOYSA-N
PubChem Substance ID3037959
InChIInChI=1S/C7H6N4S.ClH/c12-7-9-6(10-11-7)5-2-1-3-8-4-5;/h1-4H,(H2,9,10,11,12);1H
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安全信息

RTECSXZ5354000
TYPE OF TEST            : LD05 - Lethal Dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 120 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 9,42,1966

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