HRID1130982

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID8857

Ethyl acetate

C4H8O2

HCID30165

Iodide ion

I-

HCID70840

1H-Pyrazole, 3,5-diphenyl-

C15H12N2

HCID166653

Hydride

H-

HCID23157338

未命名化合物

PRODUCTS

生成物

结构：COC(=O)c1ccc(Cn2nc(-c3ccccc3)cc2-c2ccccc2)c(OC(C)C)c1

HCID23157367

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-4f7505febfda41d9b63889fc0576ef21
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

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