HRID205105

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

HCID11008278

2-(4-methoxyphenyl)propan-2-amine

C10H15NO

结构：CC12CCC(=O)C=C1CCC1C2CCC2(C)C(C(=O)Sc3ccccn3)CCC12

HCID19084936

未命名化合物

PRODUCTS

生成物

结构：COc1ccc(C(C)(C)NC(=O)C2CCC3C4CCC5=CC(=O)CCC5(C)C4CCC23C)cc1

HCID178490155

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-26dc8576471b4b31bd4f110cab0793e9
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

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