HRID1571998

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID7412

Benzoyl chloride

C7H5ClO

HCID8471

Triethylamine

C6H15N

结构：Cc1nc(-c2cccc(F)c2)ncc1C(=O)Nn1ccc2cc(N)ccc21

HCID59199998

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(-c2cccc(F)c2)ncc1C(=O)Nn1ccc2cc(NC(=O)c3ccccc3)ccc21

HCID59199958

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-d4308e912b6c4f64baf43948020f35b9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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