HRID1568120

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID11205

Carbon tetrabromide

CBr4

HCID11776

Triphenylphosphine

C18H15P

结构：CNC(=O)c1ccc(C=CC(=O)NCC(=O)N(C)c2ccc(Cl)c(CO)c2Cl)cc1

HCID54036443

未命名化合物

PRODUCTS

生成物

结构：CNC(=O)c1ccc(C=CC(=O)NCC(=O)N(C)c2ccc(Cl)c(CBr)c2Cl)cc1

HCID53805236

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c1d3132d8b994f7bbcc45a2c119aca33
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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