HRID183467

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID24813

Phosphoric trichloride

Cl3OP

HCID577800

4-(pyrrolidin-1-ylcarbonyl)aniline

C11H14N2O

结构：Cc1ccccc1C(NC(=O)Nc1ccc(Cl)cc1)C(=O)O

HCID68689841

未命名化合物

PRODUCTS

生成物

结构：Cc1ccccc1C(NC(=O)Nc1ccc(Cl)cc1)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1

HCID11569430

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2d294799c56148aa8f6e13a7ddab3da2
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

[CH3:1][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.[ClH:23].[N:24]1([C:29](=[O:30])[c:31]2[cH:32][cH:33][c:34]([NH2:37])[cH:35][cH:36]2)[CH2:25][CH2:26][CH2:27][CH2:28]1.[P:38]([Cl:39])([Cl:40])([Cl:41])=[O:42].[cH:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1>>[CH3:1][c:2]1[c:3]([CH:8]([C:9](=[O:11])[NH:37][c:34]2[cH:33][cH:32][c:31]([C:29]([N:24]3[CH2:25][CH2:26][CH2:27][CH2:28]3)=[O:30])[cH:36][cH:35]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