HRID2228165

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6328

Methyl iodide

CH3I

结构：Cc1ccc(-c2ccc3c(c2)C=C(C(=O)Nc2ccc(CN(C)C4CCOCC4)cc2)CCC3)cc1

HCID3013430

未命名化合物

PRODUCTS

生成物

结构：Cc1ccc(-c2ccc3c(c2)C=C(C(=O)Nc2ccc(C[N+](C)(C)C4CCOCC4)cc2)CCC3)cc1.[I-]

HCID9873888

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID6228

N,N-Dimethylformamide

C3H7NO

PROCEDURE

实验过程

A solution of 2—(4-methylphenyl)-N-(4—((N-tetrahydropyran-4-yl-N-methylamino)methyl)phenyl)-6,7-dihydro-5H-benzocycloheptene-8-carboxamide (0.11 g) and methyl iodide (0.02 ml) in dimethylformamide (4 ml) was stirred at room temperature over night. The solvent was evaporated, and to the residue was added ethyl acetate. Precipitated crude crystal was filtered, which was recrystallized from ethanol-ethyl acetate to give N,N-dimethyl-N-(4—((2—(4-methylphenyl)-6,7-dihydro-5H-benzocyclohepten-8-yl)carbonyl)aminobenzyl)-N-(4-tetrahydropyranyl)ammonium iodide (Compound 220) (0.13 g) as pale yellow crystals.

WORKUP

后处理

customThe solvent was evaporated
additionto the residue was added ethyl acetate
customPrecipitated crude crystal
filtrationwas filtered
customwhich was recrystallized from ethanol-ethyl acetate

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-18973177df1742d3b6c00629f46c10ae
来源数据集: uspto-grants-2002_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US06413947B1
来源说明: uspto-grants-2002_07

反应 SMILES

[CH3:1][C:2]1[CH:7]=[CH:6][C:5]([C:8]2[CH:9]=[CH:10][C:11]3[CH2:17][CH2:16][CH2:15][C:14]([C:18]([NH:20][C:21]4[CH:26]=[CH:25][C:24]([CH2:27][N:28]([CH:30]5[CH2:35][CH2:34][O:33][CH2:32][CH2:31]5)[CH3:29])=[CH:23][CH:22]=4)=[O:19])=[CH:13][C:12]=3[CH:36]=2)=[CH:4][CH:3]=1.[CH3:37][I:38]>CN(C)C=O>[I-:38].[CH3:29][N+:28]([CH3:37])([CH2:27][C:24]1[CH:25]=[CH:26][C:21]([NH:20][C:18]([C:14]2[CH2:15][CH2:16][CH2:17][C:11]3[CH:10]=[CH:9][C:8]([C:5]4[CH:6]=[CH:7][C:2]([CH3:1])=[CH:3][CH:4]=4)=[CH:36][C:12]=3[CH:13]=2)=[O:19])=[CH:22][CH:23]=1)[CH:30]1[CH2:31][CH2:32][O:33][CH2:34][CH2:35]1