HRID100185

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID67709

1,1,1-Trifluoro-2-iodoethane

C2H2F3I

HCID104967

Cesium(1+)

Cs+

2 次

结构：c1ccc2nc(COc3ccc(-c4[nH]ncc4-c4ccncc4)cc3)ccc2c1

HCID11610553

2-({4-[4-(4-Pyridinyl)-1H-pyrazol-5-yl]phenoxy}methyl)quinoline

C24H18N4O

PRODUCTS

生成物

结构：FC(F)(F)Cn1cc(-c2ccncc2)c(-c2ccc(OCc3ccc4ccccc4n3)cc2)n1

HCID11648276

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-0cdc64e2fca04837a6cde22e56d98b97
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

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