HRID695941

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID95114

2-Propenamide, N,N-di-2-propenyl-

C9H13NO

结构：COC(=O)c1cc(Br)cc(C)c1N(Cc1cccnc1)S(=O)(=O)c1ccc(OC)cc1

HCID70053864

未命名化合物

PRODUCTS

生成物

结构：C=CCN(CC=C)C(=O)C=Cc1cc(C)c(N(Cc2cccnc2)S(=O)(=O)c2ccc(OC)cc2)c(C(=O)OC)c1

HCID70054299

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b36c61b72ed04607bb12eba72a5c1aaf
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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