HRID1130284

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID19660

Carbonate

CO3-2

HCID104967

Cesium(1+)

Cs+

2 次

HCID1653580

1-(Propan-2-yl)-1,3-dihydro-2H-benzimidazol-2-one

C10H12N2O

HCID22349309

未命名化合物

PRODUCTS

生成物

结构：CC(C)CCn1c(Cn2c(=O)n(C(C)C)c3ccccc32)nc2cc(C#N)ccc21

HCID22349324

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-734059f4e244449986c8f15a3f572db3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (7/10)

反应 SMILES

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