HRID1139354

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID24813

Phosphoric trichloride

Cl3OP

HCID58897692

未命名化合物

结构：O=C(Nc1ccc(Cl)cc1)NC(C(=O)O)c1ccccc1F

HCID68695741

未命名化合物

PRODUCTS

生成物

结构：CN(C)Cc1ccccc1-c1ccc(NC(=O)C(NC(=O)Nc2ccc(Cl)cc2)c2ccccc2F)cc1

HCID11720698

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-af9c658eae4b488bb17ac801aeff127f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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