HRID300253

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID6813

Benzoic acid, 2-benzoyl-

C14H10O3

HCID8471

Triethylamine

C6H15N

HCID65578

Ethanedioyl dichloride

C2Cl2O2

结构：CN(CC(c1ccccc1)c1ccccc1)C(=O)C(NCCc1c[nH]cn1)c1ccccc1

HCID178483172

未命名化合物

PRODUCTS

生成物

结构：CN(CC(c1ccccc1)c1ccccc1)C(=O)C(c1ccccc1)N(CCc1c[nH]cn1)C(=O)c1ccccc1C(=O)c1ccccc1

HCID178483171

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0c70f64a93c6476cb5a9290c2a2811b5
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

[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10]([C:11](=[O:12])[OH:13])[cH:14][cH:15][cH:16][cH:17]1.[CH2:24]([Cl:25])[Cl:26].[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH3:67][N:68]([CH3:69])[CH:70]=[O:71].[Cl:18][C:19]([C:20]([Cl:21])=[O:22])=[O:23].[c:34]1([CH:40]([CH2:41][N:42]([C:43]([CH:44]([c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[NH:51][CH2:52][CH2:53][c:54]2[n:55][cH:56][nH:57][cH:58]2)=[O:59])[CH3:60])[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[C:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)(=[O:8])[c:9]1[c:10]([C:11](=[O:13])[N:51]([CH:44]([C:43]([N:42]([CH2:41][CH:40]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[CH3:60])=[O:59])[c:45]2[cH:46][cH:47][cH:48][cH:49][cH:50]2)[CH2:52][CH2:53][c:54]2[n:55][cH:56][nH:57][cH:58]2)[cH:14][cH:15][cH:16][cH:17]1