HRID160518

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID28557

18-Crown-6

C12H24O6

HCID139106

4-Phenylpyrazole

C9H8N2

HCID2796614

ethyl 2-chloronicotinate

C8H8ClNO2

PRODUCTS

生成物

HCID66719926

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-700ade08ef4a4f489412c954cb7b4771
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

[CH3:48][N:49]([CH3:50])[CH:51]=[O:52].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])[cH:9][cH:10][cH:11][n:12]1.[K+:24].[K+:25].[O-:26][C:27]([O-:28])=[O:29].[O:30]1[CH2:31][CH2:32][O:33][CH2:34][CH2:35][O:36][CH2:37][CH2:38][O:39][CH2:40][CH2:41][O:42][CH2:43][CH2:44][O:45][CH2:46][CH2:47]1.[OH2:53].[c:13]1(-[c:19]2[cH:20][n:21][nH:22][cH:23]2)[cH:14][cH:15][cH:16][cH:17][cH:18]1>>[c:2]1(-[n:22]2[n:21][cH:20][c:19](-[c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[cH:23]2)[c:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])[cH:9][cH:10][cH:11][n:12]1