HRID1236145

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID702

Ethanol

C2H6O

HCID10006

2,4-Imidazolidinedione

C3H4N2O2

HCID31268

Pyrrolidine

C4H9N

结构：COc1ccc(C=O)cc1-c1cc2c(cc1C)C(C)(C)CCC2(C)C

HCID11279126

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C=C2NC(=O)NC2=O)cc1-c1cc2c(cc1C)C(C)(C)CCC2(C)C

HCID69462356

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0659af7876ac4ae2a6b1b769f567aa3a
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

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