458783
1,3-二(苄氧基羰基)-2-甲基异硫代脲
95%
别名:
1,3-双(苄氧基羰基)-2-甲基异硫脲, 2-甲基-1,3-二-Z-异硫脲
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关于此项目
线性分子式:
C6H5CH2O2CN=C(SCH3)NHCO2CH2C6H5
CAS Number:
分子量:
358.41
Beilstein:
9211307
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22
质量水平
方案
95%
表单
solid
mp
60-63 °C (lit.)
官能团
amine
phenyl
thioether
SMILES字符串
CS\C(NC(=O)OCc1ccccc1)=N/C(=O)OCc2ccccc2
InChI
1S/C18H18N2O4S/c1-25-16(19-17(21)23-12-14-8-4-2-5-9-14)20-18(22)24-13-15-10-6-3-7-11-15/h2-11H,12-13H2,1H3,(H,19,20,21,22)
InChI key
CGAMNSKIHXUDMK-UHFFFAOYSA-N
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储存分类代码
11 - Combustible Solids
WGK
WGK 3
闪点(°F)
Not applicable
闪点(°C)
Not applicable
个人防护装备
Eyeshields, Gloves, type N95 (US)
历史批次信息供参考:
分析证书(COA)
Lot/Batch Number
Jun Shimokawa et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 11(23), 6878-6888 (2005-09-15)
Asymmetric total synthesis of batzelladine A (1) and batzelladine D (2) has been achieved. Our synthesis of batzelladines features 1) stereoselective construction of the cyclic guanidine system by means of successive 1,3-dipolar cycloaddition reaction and subsequent cyclization, 2) direct esterification
David M Raffel et al.
Journal of medicinal chemistry, 50(9), 2078-2088 (2007-04-11)
The norepinephrine transporter (NET) substrates [123I]-m-iodobenzylguanidine (MIBG) and [11C]-m-hydroxyephedrine (HED) are used as markers of cardiac sympathetic neurons and adrenergic tumors (pheochromocytoma, neuroblastoma). However, their rapid NET transport rates limit their ability to provide accurate measurements of cardiac nerve density.
Application of molecular topology to the search of novel NSAIDs: experimental validation of activity.
Galvez-Llompart M, et al.
Letters in Drug Design & Discovery, 7(6), 438-445 (2010)
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