HRID96195

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID6367

Acetyl chloride

C2H3ClO

HCID81531

Diisopropylethylamine

C8H19N

结构：COc1ccc(C(=O)N2c3ccccc3C(NC3CCCC3)CC2C)cc1

HCID77551852

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(=O)N2c3ccccc3C(N(C(C)=O)C3CCCC3)CC2C)cc1

HCID77551647

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fcc081d50f994457818b5adc89477984
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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