HRID1572696

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

HCID68526

1-Bromo-2-phenoxyethane

C8H9BrO

结构：COc1cc(C(=O)NCc2ccc(-c3noc(C)n3)cc2N)cc(OC)c1C

HCID69491883

未命名化合物

PRODUCTS

生成物

结构：COc1cc(C(=O)NCc2ccc(-c3noc(C)n3)cc2NCCOc2ccccc2)cc(OC)c1C

HCID69489603

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8811b1612bcd4cecbb70c42e695260b6
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应 SMILES

[Br:35][CH2:36][CH2:37][O:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[C:29](=[O:30])([O-:31])[O-:32].[K+:33].[K+:34].[NH2:1][c:2]1[c:3]([CH2:4][NH:5][C:6]([c:7]2[cH:8][c:9]([O:16][CH3:17])[c:10]([CH3:15])[c:11]([O:13][CH3:14])[cH:12]2)=[O:18])[cH:19][cH:20][c:21](-[c:23]2[n:24][o:25][c:26]([CH3:28])[n:27]2)[cH:22]1.[O:45]=[CH:46][N:47]([CH3:48])[CH3:49]>>[NH:1]([c:2]1[c:3]([CH2:4][NH:5][C:6]([c:7]2[cH:8][c:9]([O:16][CH3:17])[c:10]([CH3:15])[c:11]([O:13][CH3:14])[cH:12]2)=[O:18])[cH:19][cH:20][c:21](-[c:23]2[n:24][o:25][c:26]([CH3:28])[n:27]2)[cH:22]1)[CH2:36][CH2:37][O:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1