HRID2125387

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID259

Bromide

Br-

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6328

Methyl iodide

CH3I

HCID8857

Ethyl acetate

C4H8O2

HCID16028

Tetrabutylammonium

C16H36N+

HCID19660

Carbonate

CO3-2

结构：CCCN(C)c1cc(C(=O)OC)cc(NS(C)(=O)=O)n1

HCID68814746

未命名化合物

PRODUCTS

生成物

结构：CCCN(C)c1cc(C(=O)OC)cc(N(C)S(C)(=O)=O)n1

HCID68815178

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f2a681ea76194449987fb69222b6967a
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

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