HRID678709

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11

1,2-Dichloroethane

C2H4Cl2

HCID1645

3-Aminobenzamide

C7H8N2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID75771

1-Hydroxybenzotriazole

C6H5N3O

HCID81531

Diisopropylethylamine

C8H19N

HCID693157

(4-bromo-2-chlorophenoxy)acetic acid

C8H6BrClO3

PRODUCTS

生成物

结构：NC(=O)c1cccc(NC(=O)COc2ccc(Br)cc2Cl)c1

HCID24811106

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-685088664ee04eb88ba1493ba63f3d5c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

[Br:1][c:2]1[cH:3][c:4]([Cl:13])[c:5]([O:6][CH2:7][C:8](=[O:9])[OH:10])[cH:11][cH:12]1.[CH2:24]([Cl:25])[CH2:26][Cl:27].[CH:38]([N:39]([CH2:40][CH3:41])[CH:42]([CH3:43])[CH3:44])([CH3:45])[CH3:46].[NH2:14][c:15]1[cH:16][c:17]([C:18](=[O:19])[NH2:20])[cH:21][cH:22][cH:23]1.[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[OH:28][n:29]1[c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]2[n:36][n:37]1>>[Br:1][c:2]1[cH:3][c:4]([Cl:13])[c:5]([O:6][CH2:7][C:8](=[O:10])[NH:14][c:15]2[cH:16][c:17]([C:18](=[O:19])[NH2:20])[cH:21][cH:22][cH:23]2)[cH:11][cH:12]1