HRID323248

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COc1ccc(C(=O)N2CCC(CCOS(C)(=O)=O)(c3ccccc3)C2)c(OC)c1OC

HCID18464757

未命名化合物

HCID86754231

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(=O)N2CCC(CCN3CCC(Nc4nc5ccccc5[nH]4)CC3)(c3ccccc3)C2)c(OC)c1OC

HCID9873096

未命名化合物

PROCEDURE

实验过程

Prepare by the method of Example 4.1 using 1-(2,3,4-trimethoxybenzoyl)-3-phenyl-3-(2-methanesulfonyloxyethyl)pyrrolidine (1.1 g, 2.3 mmol) and (1H-benzimidazol-2-yl)(piperidin-4-yl)amine hydriodic acid salt (1.21 g, 2.6 mmol). Purify by chromatography on silica gel eluting 28% methanol/ethyl acetate containing 20 mL concentrated aqueous ammonia solution/3L to give the title compound: mp; 112-119° C.

WORKUP

后处理

customPurify by chromatography on silica gel eluting 28% methanol/ethyl acetate containing 20 mL concentrated aqueous ammonia solution/3L

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0c1509830f93412eb1817c368082989f
来源数据集: uspto-grants-2001_04
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06211199B1
来源说明: uspto-grants-2001_04

反应 SMILES

[CH3:1][O:2][C:3]1[C:28]([O:29][CH3:30])=[C:27]([O:31][CH3:32])[CH:26]=[CH:25][C:4]=1[C:5]([N:7]1[CH2:11][CH2:10][C:9]([C:19]2[CH:24]=[CH:23][CH:22]=[CH:21][CH:20]=2)([CH2:12][CH2:13]OS(C)(=O)=O)[CH2:8]1)=[O:6].I.[NH:34]1[C:38]2[CH:39]=[CH:40][CH:41]=[CH:42][C:37]=2[N:36]=[C:35]1[NH:43][CH:44]1[CH2:49][CH2:48][NH:47][CH2:46][CH2:45]1>>[CH3:1][O:2][C:3]1[C:28]([O:29][CH3:30])=[C:27]([O:31][CH3:32])[CH:26]=[CH:25][C:4]=1[C:5]([N:7]1[CH2:11][CH2:10][C:9]([CH2:12][CH2:13][N:47]2[CH2:46][CH2:45][CH:44]([NH:43][C:35]3[NH:34][C:38]4[CH:39]=[CH:40][CH:41]=[CH:42][C:37]=4[N:36]=3)[CH2:49][CH2:48]2)([C:19]2[CH:24]=[CH:23][CH:22]=[CH:21][CH:20]=2)[CH2:8]1)=[O:6]