HRID165800

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID81531

Diisopropylethylamine

C8H19N

HCID144895

2,4,6-Trifluorobenzoyl chloride

C7H2ClF3O

HCID67279322

未命名化合物

PRODUCTS

产物

HCID58025831

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-4d06fdc9519e428f81d539a8815ed66d
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

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