HRID153731

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID180

Acetone

C3H6O

HCID813

Potassium cation

K+

2 次

HCID19660

Carbonate

CO3-2

HCID619503

2-methyl-4,4-diphenyl-1H-imidazol-5-one

C16H14N2O

HCID11966043

Ethyl 4-(2-bromoacetyl)benzoate

C11H11BrO3

PRODUCTS

生成物

结构：CCOC(=O)c1ccc(C(=O)CN2C(=O)C(c3ccccc3)(c3ccccc3)N=C2C)cc1

HCID68464053

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9a208f281de6485d901e7e3e410178ef
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (9/10)

反应 SMILES

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