HRID184067

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7669

N-Methylbenzylamine

C8H11N

HCID81531

Diisopropylethylamine

C8H19N

结构：O=C(O)c1cccc(N2CCN(CCC(c3ccccc3)c3ccccc3)CC2)c1

HCID22180487

未命名化合物

PRODUCTS

生成物

结构：CN(Cc1ccccc1)C(=O)c1cccc(N2CCN(CCC(c3ccccc3)c3ccccc3)CC2)c1

HCID22180276

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-05dd1bf9e1a347f6a622e778c61200db
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:40][NH:41][CH2:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[CH:31]([N:32]([CH:33]([CH3:34])[CH3:35])[CH2:36][CH3:37])([CH3:38])[CH3:39].[Cl:49][CH2:50][Cl:51].[c:1]1([CH:7]([CH2:8][CH2:9][N:10]2[CH2:11][CH2:12][N:13]([c:16]3[cH:17][c:18]([C:19](=[O:20])[OH:21])[cH:22][cH:23][cH:24]3)[CH2:14][CH2:15]2)[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([CH2:8][CH2:9][N:10]2[CH2:11][CH2:12][N:13]([c:16]3[cH:17][c:18]([C:19](=[O:21])[N:41]([CH3:40])[CH2:42][c:43]4[cH:44][cH:45][cH:46][cH:47][cH:48]4)[cH:22][cH:23][cH:24]3)[CH2:14][CH2:15]2)[c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1