HRID282063

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID313

Hydrochloric Acid

ClH

HCID887

Methanol

CH4O

反应SMILES：CCc1ccc(NC(=O)OCC2(C(=O)NCc3ccccc3Cl)CCN(C(=O)CNC(=O)OC(C)(C)C)CC2)cc1

HCID59778528

未命名化合物

PRODUCTS

产物

反应SMILES：CCc1ccc(NC(=O)OCC2(C(=O)NCc3ccccc3Cl)CCN(C(=O)CN)CC2)cc1

HCID59778431

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-904ad26155094e069298377f00d2d504
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应SMILES

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