HRID679299

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID923

Sodium ion

Na+

HCID11251

3-Methyl-2-butanone

C5H10O

HCID19660

Carbonate Ion

CO3-2

HCID30165

Iodide ion

I-

HCID11010825

1-Bromo-4-(2-bromoethyl)benzene

C8H8Br2

HCID21301001

未命名化合物

PRODUCTS

产物

HCID21301014

7-[2-(4-Bromophenyl)ethyl]-2-(3,5-dichlorophenyl)-tetrahydro-imidazo[1,5-a]pyrazine-1,3-dione

C20H18BrCl2N3O2

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-e1f156a3d52a4cf3af1623c03f86c3a6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应SMILES

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