HRID208482

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID1049

Pyridine

C5H5N

HCID7121

3,4-Dimethoxybenzoic acid

C9H10O4

HCID24813

Phosphoric trichloride

Cl3OP

HCID11529455

N-(3-amino-4-methylphenyl)-3-(trifluoromethyl)benzamide

C15H13F3N2O

PRODUCTS

生成物

结构：COc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)cc1OC

HCID23443373

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-316d4e0c86cd4f22978a14a0119524f8
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

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