HRID92812

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6328

Methyl iodide

CH3I

结构：O=C(Nc1ccc(CN2CCOCC2)cc1)C1=Cc2cc(-c3ccccc3)ccc2CC1

HCID10788468

未命名化合物

PRODUCTS

生成物

HCID30165

Iodide ion

I-

结构：C[N+]1(Cc2ccc(NC(=O)C3=Cc4cc(-c5ccccc5)ccc4CC3)cc2)CCOCC1

HCID474151

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b887582072ce4aaf8ab1c9772c01a27e
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:33][I:34].[O:1]1[CH2:2][CH2:3][N:4]([CH2:7][c:8]2[cH:9][cH:10][c:11]([NH:14][C:15](=[O:16])[C:17]3=[CH:18][c:19]4[cH:20][c:21](-[c:27]5[cH:28][cH:29][cH:30][cH:31][cH:32]5)[cH:22][cH:23][c:24]4[CH2:25][CH2:26]3)[cH:12][cH:13]2)[CH2:5][CH2:6]1.[O:35]=[CH:36][N:37]([CH3:38])[CH3:39]>>[I-:34].[O:1]1[CH2:2][CH2:3][N+:4]([CH2:7][c:8]2[cH:9][cH:10][c:11]([NH:14][C:15](=[O:16])[C:17]3=[CH:18][c:19]4[cH:20][c:21](-[c:27]5[cH:28][cH:29][cH:30][cH:31][cH:32]5)[cH:22][cH:23][c:24]4[CH2:25][CH2:26]3)[cH:12][cH:13]2)([CH3:33])[CH2:5][CH2:6]1