HRID99270

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1140

Toluene

C7H8

HCID2737674

2-fluoro-4-(trifluoromethyl)aniline

C7H5F4N

HCID16682925

Aluminum, trimethyl-

C3H9Al

HCID178496992

未命名化合物

PRODUCTS

产物

HCID178422765

2-((3,5-Dichloropyridin-4-yl)amino)-N-(2-fluoro-4-(trifluoromethyl)phenyl)-7,7-dimethyl-7,8-dihydro-1H-benzofuro[4,5-d]imidazole-5-carboxamide

C24H17Cl2F4N5O2

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-157b9cb16fa7469eafa703ac997187e8
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

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