HRID1137526

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID3776

Isopropanol

C3H8O

HCID6344

Dichloromethane

CH2Cl2

2 次

HCID81531

Diisopropylethylamine

C8H19N

HCID10921653

未命名化合物

HCID59314362

未命名化合物

PRODUCTS

产物

HCID59314093

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-3e760192684e45199f789fcdb3ab6197
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应SMILES

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