HRID150693

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID312

Chloride

Cl-

HCID6228

Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID12249

1-Propanamine, N,2-dimethyl-

C5H13N

HCID24386

Thionyl Chloride

Cl2OS

HCID18613108

未命名化合物

PRODUCTS

产物

HCID10279060

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-41846ebe005b4af5ad0e1d67014af51d
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应SMILES

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