1-Amino-5-(4-pyridyl)-1H-1,2,4-triazole-3-thiol
CAS 4923-02-8 MFCD01678527
化学结构图
SMILES: Nn1[nH]c(=S)nc1-c1ccncc1
化学属性
| Mol. Formula | C7H7N5S |
|---|---|
| Mol. Weight | 193.25 |
别名和识别编码
| Chemical Name | 1H-1,2,4-Triazole-3-thiol, 1-amino-5-(4-pyridyl)- |
|---|---|
| Wiswesser Line Notation | T6NJ D- CT5NN DNJ BZ ESH |
| Synonym | Pyridine, 4-(1-amino-3-mercapto-1H-1,2,4-triazol-5-yl)- 1-Amino-5-(4-pyridyl)-1H-1,2,4-triazole-3-thiol |
| Beilstein Registry Number | 2975635 |
| CAS Number | 4923-02-8 |
| InChIKey | CLLIRGCEQYSYFS-UHFFFAOYSA-N |
| PubChem Substance ID | 3037958 |
| InChI | InChI=1S/C7H7N5S/c8-12-6(10-7(13)11-12)5-1-3-9-4-2-5/h1-4H,8H2,(H,11,13) |
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安全信息
TYPE OF TEST : LD05 - Lethal Dose ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 370 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
