HRID1234874

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID595993

4-(Diethoxymethyl)benzaldehyde

C12H16O3

结构：CN(C)S(=O)(=O)n1ccnc1CNCc1nccn1S(=O)(=O)N(C)C

HCID67285794

未命名化合物

PRODUCTS

生成物

结构：CCOC(OCC)c1ccc(CN(Cc2nccn2S(=O)(=O)N(C)C)Cc2nccn2S(=O)(=O)N(C)C)cc1

HCID67284731

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-02e3d778f73644cc95bf96b6c3c87d68
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

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