HRID1549124

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19660

Carbonate

CO3-2

HCID31374

Dimethylacetamide

C4H9NO

HCID33643

1-Iodopropane

C3H7I

HCID104967

Cesium(1+)

Cs+

2 次

结构：CS(=O)(=O)c1cccc(-c2ccc(CNS(=O)(=O)c3ccccc3C(F)(F)F)s2)c1

HCID67440497

未命名化合物

PRODUCTS

生成物

结构：CCCN(Cc1ccc(-c2cccc(S(C)(=O)=O)c2)s1)S(=O)(=O)c1ccccc1C(F)(F)F

HCID25234243

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fc4428b78c7f4d72a8b504254194e663
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

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