HRID180411

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID19660

Carbonate

CO3-2

HCID24350

Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

CuI

HCID31275

1,4-Dioxane

C4H8O2

HCID104967

Cesium(1+)

Cs+

2 次

HCID551074

N,N'-Dimethyl-1,2-cyclohexanediamine

C8H18N2

结构：CC(C)(C)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2I)cc1

HCID59428152

未命名化合物

HCID178420751

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2-n2nnc3ncccc32)cc1

HCID25134921

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0f6490f0c9b8455683bbaf12c88927fc
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:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[NH:14][c:15]2[c:16]([I:22])[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[cH:9][cH:10]1.[C:32](=[O:33])([O-:34])[O-:35].[CH3:38][NH:39][CH:40]1[CH2:41][CH2:42][CH2:43][CH2:44][CH:45]1[NH:46][CH3:47].[Cs+:36].[Cs+:37].[Cu:48][I:49].[O:50]1[CH2:51][CH2:52][O:53][CH2:54][CH2:55]1.[nH:23]1[n:24][n:25][c:26]2[c:27]1[cH:28][cH:29][cH:30][n:31]2>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([S:11](=[O:12])(=[O:13])[NH:14][c:15]2[c:16](-[n:23]3[n:24][n:25][c:26]4[c:27]3[cH:28][cH:29][cH:30][n:31]4)[cH:17][c:18]([Cl:21])[cH:19][cH:20]2)[cH:9][cH:10]1