HRID695318

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6328

Methyl iodide

CH3I

反应SMILES：CCOc1ccc(S(=O)(=O)NC(CC(=O)OCc2ccccc2)CN(C)C)cc1NC(=O)N1CCOCC1

HCID178466870

未命名化合物

PRODUCTS

产物

HCID30165

Iodide ion

I-

反应SMILES：CCOc1ccc(S(=O)(=O)NC(CC(=O)OCc2ccccc2)C[N+](C)(C)C)cc1NC(=O)N1CCOCC1

HCID178466871

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-71cd90c290384d869eba522fbdf0fe9a
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

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