1H-1,2,4-Triazole-3-thiol, 5-(p-ureidophenyl)-

CAS 3414-98-0 MFCD01678554

化学结构图

3414-98-0
SMILES: NC(=O)Nc1ccc(-c2nc(S)n[nH]2)cc1

化学属性

Mol. FormulaC9H9N5OS
Mol. Weight235.29

别名和识别编码

Chemical Name1H-1,2,4-Triazole-3-thiol, 5-(p-ureidophenyl)-
Wiswesser Line NotationT5MN DNJ CSH ER DMVZ
Synonym 5-(p-Ureidophenyl)-1H-1,2,4-triazole-3-thiol Urea, 1-(p-(3-mercapto-s-triazol-5-yl)phenyl)- p-(3-Mercapto-s-triazol-5-yl)phenylurea
Beilstein Registry Number2985930
CAS Number3414-98-0
InChIKeyZQYMUOLZXUSCAN-UHFFFAOYSA-N
PubChem Substance ID3037992
InChIInChI=1S/C9H9N5OS/c10-8(15)11-6-3-1-5(2-4-6)7-12-9(16)14-13-7/h1-4H,(H3,10,11,15)(H2,12,13,14,16)
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安全信息

RTECSXZ5358300
TYPE OF TEST            : LD05 - Lethal Dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 198 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

系列性分类


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