HRID190877

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID8078

Cyclohexane

C6H12

HCID8857

Ethyl acetate

C4H8O2

HCID2735178

2-(methylsulfonyl)benzenesulfonyl chloride

C7H7ClO4S2

结构：C[Si](C)(C)CCOCn1nc(-c2nc3ccccc3[nH]2)c2cc(N)ccc21

HCID136336345

未命名化合物

PRODUCTS

生成物

结构：C[Si](C)(C)CCOCn1nc(-c2nc3ccccc3[nH]2)c2cc(NS(=O)(=O)c3ccccc3S(C)(=O)=O)ccc21

HCID135621934

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3becf322653e4110bdc7b0f9143d01d3
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

[C:48]([O:49][CH2:50][CH3:51])(=[O:52])[CH3:53].[CH2:54]1[CH2:55][CH2:56][CH2:57][CH2:58][CH2:59]1.[CH3:34][S:35](=[O:36])(=[O:37])[c:38]1[c:39]([S:44](=[O:45])(=[O:46])[Cl:47])[cH:40][cH:41][cH:42][cH:43]1.[cH:28]1[cH:29][cH:30][n:31][cH:32][cH:33]1.[nH:1]1[c:2](-[c:10]2[n:11][n:12]([CH2:20][O:21][CH2:22][CH2:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[c:13]3[cH:14][cH:15][c:16]([NH2:19])[cH:17][c:18]23)[n:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2>>[n:1]1[c:2](-[c:10]2[n:11][n:12]([CH2:20][O:21][CH2:22][CH2:23][Si:24]([CH3:25])([CH3:26])[CH3:27])[c:13]3[cH:14][cH:15][c:16]([NH:19][S:44]([c:39]4[c:38]([S:35]([CH3:34])(=[O:36])=[O:37])[cH:43][cH:42][cH:41][cH:40]4)(=[O:45])=[O:46])[cH:17][c:18]23)[nH:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2