HRID524688

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID14787051

Chloromethyl propan-2-yl carbonate

C5H9ClO3

结构：CCOC(=O)C1=C(CN2CCOCC2C(=O)O)NC(c2nccs2)=NC1c1ccc(Cl)cc1Cl

HCID73295969

未命名化合物

PRODUCTS

生成物

结构：CCOC(=O)C1=C(CN2CCOCC2C(=O)OCOC(=O)OC(C)C)NC(c2nccs2)=NC1c1ccc(Cl)cc1Cl

HCID90043629

未命名化合物

收率 47%

PROCEDURE

实验过程

4-((6-(2,4-dichlorophenyl)-5-(ethoxycarbonyl)-2-(thiazol-2-yl)-3,6-dihydropyrimidin-4-yl)methyl)morpholine-3-carboxylic acid (0.22 g, 0.4 mmol) was reacted with chloromethyl isopropyl carbonate (0.25 g, 1.64 mmol) according to the procedure as described in Example 79 to give the title compound as yellow oil (0.12 g, 47%). The compound was characterized by the following spectroscopic data:

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b7cabf4a04fd446eb95fbf221abcaba3
来源数据集: uspto-grants-2016_05
DOI: 10.6084/m9.figshare.5104873.v1
专利: US09340538B2
来源说明: uspto-grants-2016_05

反应 SMILES

[Cl:1][C:2]1[CH:7]=[C:6]([Cl:8])[CH:5]=[CH:4][C:3]=1[CH:9]1[N:14]=[C:13]([C:15]2[S:16][CH:17]=[CH:18][N:19]=2)[NH:12][C:11]([CH2:20][N:21]2[CH2:26][CH2:25][O:24][CH2:23][CH:22]2[C:27]([OH:29])=[O:28])=[C:10]1[C:30]([O:32][CH2:33][CH3:34])=[O:31].[C:35](=[O:43])([O:39][CH:40]([CH3:42])[CH3:41])[O:36][CH2:37]Cl>>[Cl:1][C:2]1[CH:7]=[C:6]([Cl:8])[CH:5]=[CH:4][C:3]=1[CH:9]1[N:14]=[C:13]([C:15]2[S:16][CH:17]=[CH:18][N:19]=2)[NH:12][C:11]([CH2:20][N:21]2[CH2:26][CH2:25][O:24][CH2:23][CH:22]2[C:27]([O:29][CH2:37][O:36][C:35]([O:39][CH:40]([CH3:42])[CH3:41])=[O:43])=[O:28])=[C:10]1[C:30]([O:32][CH2:33][CH3:34])=[O:31]