HRID2145265

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6344

Dichloromethane

CH2Cl2

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

HCID4571096

3-Aminocarbonyl-1-Boc-pyrrolidine

C10H18N2O3

结构：O=c1c2sc(-c3ccc(Cl)cc3)cc2ccn1-c1ccc(Br)cc1

HCID68953147

未命名化合物

PRODUCTS

生成物

结构：CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(-n3ccc4cc(-c5ccc(Cl)cc5)sc4c3=O)cc2)C1

HCID68949953

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-1be2523340ce4da9818e23773c51e719
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:16][c:17]1[cH:18][cH:19][c:20](-[n:23]2[c:24](=[O:39])[c:25]3[c:26]([cH:27][cH:28]2)[cH:29][c:30](-[c:32]2[cH:33][cH:34][c:35]([Cl:38])[cH:36][cH:37]2)[s:31]3)[cH:21][cH:22]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([C:13]([NH2:14])=[O:15])[CH2:11][CH2:12]1.[C:40](=[O:41])([O-:42])[O-:43].[CH2:46]1[O:47][CH2:48][CH2:49][O:50][CH2:51]1.[Cl:52][CH2:53][Cl:54].[Cs+:44].[Cs+:45].[Cu:55][I:56]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([C:13]([NH:14][c:17]2[cH:18][cH:19][c:20](-[n:23]3[c:24](=[O:39])[c:25]4[c:26]([cH:27][cH:28]3)[cH:29][c:30](-[c:32]3[cH:33][cH:34][c:35]([Cl:38])[cH:36][cH:37]3)[s:31]4)[cH:21][cH:22]2)=[O:15])[CH2:11][CH2:12]1