HRID212745

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID962

Water

H2O

HCID6344

Dichloromethane

CH2Cl2

HCID8471

Triethylamine

C6H15N

HCID11123

2,4-Dichloroaniline

C6H5Cl2N

HCID22054160

未命名化合物

HCID57501467

未命名化合物

PRODUCTS

产物

HCID22054274

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-046ee712288d4380b5dcb30a39e19923
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应SMILES

[CH2:54]([Cl:55])[Cl:56].[CH3:10][CH2:11][N:12]([CH2:13][CH3:14])[CH2:15][CH3:16].[CH3:26][O:27][C:28]1=[C:33]([O:34][CH3:35])[C:32](=[O:36])[C:31]([CH2:37][c:38]2[c:39]([O:47][C:48]([CH3:49])=[O:50])[c:40]([C:41](=[O:42])[OH:43])[cH:44][cH:45][cH:46]2)=[C:30]([CH3:51])[C:29]1=[O:52].[Cl-:17].[Cl:18][CH:19]1[N:20]([CH3:21])[CH2:22][CH2:23][NH+:24]1[CH3:25].[NH2:1][c:2]1[cH:3][cH:4][c:5]([Cl:6])[cH:7][c:8]1[Cl:9].[OH2:53]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([Cl:6])[cH:7][c:8]1[Cl:9])[C:41]([c:40]1[c:39]([O:47][C:48]([CH3:49])=[O:50])[c:38]([CH2:37][C:31]2=[C:30]([CH3:51])[C:29](=[O:52])[C:28]([O:27][CH3:26])=[C:33]([O:34][CH3:35])[C:32]2=[O:36])[cH:46][cH:45][cH:44]1)=[O:42]