HRID286731

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID923

Sodium ion

Na+

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID166653

Hydride

H-

HCID3421110

2-Bromo-N-(5-chloro-2-pyridinyl)acetamide

C7H6BrClN2O

HCID178496244

未命名化合物

PRODUCTS

生成物

结构：COCCOCCOCc1cc(C(=O)OC(C)(C)C)nn1CC(=O)Nc1ccc(Cl)cn1

HCID60207966

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-170e39d8dcb5422e98a40449d56a68e8
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (8/10)

反应 SMILES

[Br:24][CH2:25][C:26](=[O:27])[NH:28][c:29]1[n:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]1.[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[c:8]1[nH:9][n:10][c:11]([CH2:13][O:14][CH2:15][CH2:16][O:17][CH2:18][CH2:19][O:20][CH3:21])[cH:12]1.[H-:22].[Na+:23].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41].[OH2:36]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[c:8]1[n:9][n:10]([CH2:25][C:26](=[O:27])[NH:28][c:29]2[n:30][cH:31][c:32]([Cl:35])[cH:33][cH:34]2)[c:11]([CH2:13][O:14][CH2:15][CH2:16][O:17][CH2:18][CH2:19][O:20][CH3:21])[cH:12]1