HRID934442

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID7498

alpha-Bromotoluene

C7H7Br

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID31374

Dimethylacetamide

C4H9NO

HCID104967

Cesium(1+)

Cs+

2 次

结构：CS(=O)(=O)c1cccc(-c2ncc(CNS(=O)(=O)c3ccccc3Cl)s2)c1

HCID67439913

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)c1cccc(-c2ncc(CN(Cc3ccccc3)S(=O)(=O)c3ccccc3Cl)s2)c1

HCID25234386

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-85b99b9019ff4d71aa2360d139a02a2b
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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