HRID1434042

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCNc1cc(OC)c(OC)cc1[C@@H]1CCc2cc(OC(=O)C(C)(C)C)ccc2C1

HCID57934541

未命名化合物

结构：CC(C)(COc1ccc(C=O)cc1F)NC(=O)OC(C)(C)C

HCID57934591

未命名化合物

PRODUCTS

生成物

结构：COc1cc(NCCCc2ccc(OCC(C)(C)N)c(F)c2)c([C@@H]2CCc3cc(O)ccc3C2)cc1OC

HCID66625859

未命名化合物

收率 51.2%

PROCEDURE

实验过程

Synthesized from pivalic acid (R)-6-(2-ethylamino-4,5-dimethoxyphenyl)-5,6,7,8-tetrahydronaphthalen-2-yl ester (20 mg) and tert-butyl[2-(2-fluoro-4-formylphenoxy)-1,1-dimethylethyl]carbamate (72 mg) according to an analogous synthetic method to Example 238 and purified by LC-MS, the title compound (13 mg) was obtained.

WORKUP

后处理

custompurified by LC-MS

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-40255414cf2745f495f182502fc21770
来源数据集: uspto-grants-2009_11
DOI: 10.6084/m9.figshare.5104873.v1
专利: US07612114B2
来源说明: uspto-grants-2009_11

反应 SMILES

[CH2:1]([NH:3][C:4]1[CH:9]=[C:8]([O:10][CH3:11])[C:7]([O:12][CH3:13])=[CH:6][C:5]=1[C@@H:14]1[CH2:23][CH2:22][C:21]2[CH:20]=[C:19]([O:24]C(=O)C(C)(C)C)[CH:18]=[CH:17][C:16]=2[CH2:15]1)[CH3:2].C(OC(=O)[NH:37][C:38]([CH3:51])([CH3:50])[CH2:39][O:40][C:41]1[CH:46]=[CH:45][C:44]([CH:47]=O)=[CH:43][C:42]=1[F:49])(C)(C)C>>[NH2:37][C:38]([CH3:51])([CH3:50])[CH2:39][O:40][C:41]1[CH:46]=[CH:45][C:44]([CH2:47][CH2:2][CH2:1][NH:3][C:4]2[CH:9]=[C:8]([O:10][CH3:11])[C:7]([O:12][CH3:13])=[CH:6][C:5]=2[C@@H:14]2[CH2:23][CH2:22][C:21]3[CH:20]=[C:19]([OH:24])[CH:18]=[CH:17][C:16]=3[CH2:15]2)=[CH:43][C:42]=1[F:49]