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Merck

458783

Sigma-Aldrich

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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About This Item

线性分子式:
C6H5CH2O2CN=C(SCH3)NHCO2CH2C6H5
CAS号:
分子量:
358.41
Beilstein:
9211307
MDL號碼:
分類程式碼代碼:
12352100
PubChem物質ID:
NACRES:
NA.22

化驗

95%

形狀

solid

mp

60-63 °C (lit.)

SMILES 字串

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 密鑰

CGAMNSKIHXUDMK-UHFFFAOYSA-N

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儲存類別代碼

11 - Combustible Solids

水污染物質分類(WGK)

WGK 3

閃點(°F)

Not applicable

閃點(°C)

Not applicable

個人防護裝備

Eyeshields, Gloves, type N95 (US)


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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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