HRID149194

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID674

Dimethylamine

C2H7N

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

结构：O=C(COc1ccc(Cl)cc1Cl)Nc1cccc(C(=O)O)c1

HCID668139

未命名化合物

PRODUCTS

生成物

结构：CN(C)C(=O)c1cccc(NC(=O)COc2ccc(Cl)cc2Cl)c1

HCID17231769

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c59a79d4e18f4f39807f4a3d20187c01
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

[CH2:26]([Cl:27])[CH2:28][Cl:29].[CH3:23][NH:24][CH3:25].[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[Cl:1][c:2]1[c:3]([O:4][CH2:5][C:6](=[O:7])[NH:8][c:9]2[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][cH:16][cH:17]2)[cH:18][cH:19][c:20]([Cl:22])[cH:21]1.[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[OH:30][n:31]1[c:32]2[c:33]([cH:34][cH:35][cH:36][cH:37]2)[n:38][n:39]1>>[Cl:1][c:2]1[c:3]([O:4][CH2:5][C:6](=[O:7])[NH:8][c:9]2[cH:10][c:11]([C:12](=[O:13])[N:24]([CH3:23])[CH3:25])[cH:15][cH:16][cH:17]2)[cH:18][cH:19][c:20]([Cl:22])[cH:21]1