HRID1225665

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID6212

Chloroform

CHCl3

HCID7477

Benzoyl chloride, 4-methoxy-

C8H7ClO2

HCID8471

Triethylamine

C6H15N

结构：Nc1cccc(-c2cccc3c2C(=Cc2ccc[nH]2)C(=O)N3)c1

HCID53972697

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(=O)Nc2cccc(-c3cccc4c3C(=Cc3ccc[nH]3)C(=O)N4)c2)cc1

HCID53872459

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-39354b0db5024032af22d8dd70ee6fcf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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