HRID670763

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6342

Acetonitrile

C2H3N

HCID19660

Carbonate

CO3-2

HCID59636743

N,N-dimethyl-7-(piperazin-1-yl)benzofuran-2-carboxamide

C15H19N3O2

HCID59636776

2-Pyridineethanol, 6-methoxy-, 2-(4-methylbenzenesulfonate)

C15H17NO4S

PRODUCTS

生成物

结构：COc1cccc(CCN2CCN(c3cccc4cc(C(=O)N(C)C)oc34)CC2)n1

HCID59636781

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-380dcd3df4784b6ca361893a46262891
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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