Pyridine, 4-(3-(2-pyridylmercapto)-5-(4H-1,2,4-triazolyl))-

CAS 3652-27-5 MFCD03652275

化学结构图

3652-27-5
SMILES: c1ccc(Sc2nc(-c3ccncc3)n[nH]2)nc1

化学属性

Mol. Weight254.31
Mol. FormulaC12H8N5S

别名和识别编码

Chemical NamePyridine, 4-(3-(2-pyridylmercapto)-5-(4H-1,2,4-triazolyl))-
Chemicalbook IDCB02353412
Wiswesser Line NotationT6NJ BS- CT5NN DMJ E- DT6NJ
Synonym 4H-1,2,4-Triazole, 3-(2-pyridylmercapto)-5-(4-pyridyl)- 3-(2-Pyridylmercapto)-5-(4-pyridyl)-1,2,4(H)-triazole
CAS Number3652-27-5
InChIKeyIVHJYIJZCMADLP-UHFFFAOYSA-N
PubChem Substance ID199044
InChIInChI=1S/C12H9N5S/c1-2-6-14-10(3-1)18-12-15-11(16-17-12)9-4-7-13-8-5-9/h1-8H,(H,15,16,17)
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安全信息

RTECSUT7645000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1470 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: 8,676,1965

系列性分类

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