HRID1209047

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID79177

Acetic acid, bromo-, 1,1-dimethylethyl ester

C6H11BrO2

结构：CC(C)Oc1ccc(-c2noc(-c3cccc4c3CCNC4)n2)cc1Cl

HCID59556681

未命名化合物

PRODUCTS

生成物

结构：CC(C)Oc1ccc(-c2noc(-c3cccc4c3CCN(CC(=O)OC(C)(C)C)C4)n2)cc1Cl

HCID59556557

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-a756f7f2f7dc4590a9500aa0756f5b1f
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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