HRID1546313

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID25134

Boron tribromide

BBr3

结构：COc1ccc2c(c1)c1c3c(c(-c4ccccc4Cl)cc1n2CCC(=O)NC1CC(C)(C)NC(C)(C)C1)C(=O)NC3=O

HCID86760209

未命名化合物

PRODUCTS

生成物

结构：CC1(C)CC(NC(=O)CCn2c3ccc(O)cc3c3c4c(c(-c5ccccc5Cl)cc32)C(=O)NC4=O)CC(C)(C)N1

HCID86760210

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-54fd67f3795c4c2eb21e88ba7025e267
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

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