HRID304461

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8471

Triethylamine

C6H15N

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID591595

N,N,N'-Trimethylbenzene-1,4-diamine

C9H14N2

HCID14390457

未命名化合物

PRODUCTS

生成物

结构：CN(C)c1ccc(N(C)C(=O)Cn2c(-c3ccc(Cl)cc3)nc3cccnc32)cc1

HCID14390370

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-6196f73dc7d3470584bdc9dc7b6eade4
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[CH3:27][N:28]([c:29]1[cH:30][cH:31][c:32]([NH:35][CH3:36])[cH:33][cH:34]1)[CH3:37].[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[c:11]([n:12][cH:13][cH:14][cH:15]3)[n:16]2[CH2:17][C:18](=[O:19])[OH:20])[cH:6][cH:7]1.[Cl:21][C:22]([C:23]([Cl:24])=[O:25])=[O:26].[OH2:38]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][c:10]3[c:11]([n:12][cH:13][cH:14][cH:15]3)[n:16]2[CH2:17][C:18](=[O:20])[N:35]([c:32]2[cH:31][cH:30][c:29]([N:28]([CH3:27])[CH3:37])[cH:34][cH:33]2)[CH3:36])[cH:6][cH:7]1