HRID1136859

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID8471

Triethylamine

C6H15N

HCID88969

Benzoyl chloride, 2-methoxy-

C8H7ClO2

结构：CC(C)c1cccc(C(C)C)c1NC(=O)CNC(c1ccccc1)c1ccccc1

HCID1645639

未命名化合物

PRODUCTS

生成物

结构：COc1ccccc1C(=O)N(CC(=O)Nc1c(C(C)C)cccc1C(C)C)C(c1ccccc1)c1ccccc1

HCID19874995

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-81a82f434ae64e679b4e2e6cfd5f503a
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

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