HRID171684

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID6344

Dichloromethane

CH2Cl2

HCID3614350

3,5-DIBROMO-1-METHYLPYRIDIN-2(1H)-ONE

C6H5Br2NO

结构：CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1ccc(CC(NC(=O)OC(C)(C)C)C(=O)OC)cc1

HCID22382042

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(Cc1ccc(-c2cc(Br)cn(C)c2=O)cc1)NC(=O)OC(C)(C)C

HCID21334954

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-324c3870845f446a9ea024921a20e7ee
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

[Br:1][c:2]1[c:3](=[O:10])[n:4]([CH3:9])[cH:5][c:6]([Br:8])[cH:7]1.[CH3:11][O:12][C:13]([CH:14]([NH:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:23][c:24]1[cH:25][cH:26][c:27]([Sn:30]([CH2:31][CH2:32][CH2:33][CH3:34])([CH2:35][CH2:36][CH2:37][CH3:38])[CH2:39][CH2:40][CH2:41][CH3:42])[cH:28][cH:29]1)=[O:43].[Cl:49][CH2:50][Cl:51].[O:44]=[CH:45][N:46]([CH3:47])[CH3:48]>>[c:2]1(-[c:27]2[cH:26][cH:25][c:24]([CH2:23][CH:14]([C:13]([O:12][CH3:11])=[O:43])[NH:15][C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[cH:29][cH:28]2)[c:3](=[O:10])[n:4]([CH3:9])[cH:5][c:6]([Br:8])[cH:7]1