HRID1227967

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID24350

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

CuI

HCID31275

1,4-Dioxane

C4H8O2

HCID73949

2-Oxazolidinone

C3H5NO2

HCID551074

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

C8H18N2

结构：CCC1C(=O)N(C)c2cnc(-n3ccnc3Br)nc2N1C1CCCC1

HCID67261755

未命名化合物

PRODUCTS

生成物

结构：CCC1C(=O)N(C)c2cnc(-n3ccnc3N3CCOC3=O)nc2N1C1CCCC1

HCID67371877

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-edec3e1484bb492c891590e0717f5a11
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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