HRID1565624

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID175

Acetate

C2H3O2-

2 次

HCID1049

Pyridine

C5H5N

HCID6344

Dichloromethane

CH2Cl2

HCID27099

Copper(2+)

Cu+2

HCID24728917

4-Bromo-1H-indazole-6-carbonitrile

C8H4BrN3

HCID54758874

[4-(Benzyloxy)-3,5-difluorophenyl]boronic acid

C13H11BF2O3

PRODUCTS

生成物

结构：N#Cc1cc(Br)c2cnn(-c3cc(F)c(OCc4ccccc4)c(F)c3)c2c1

HCID67245855

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-929560ad10404d7ab436debbe04767fe
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:1][c:2]1[c:3]2[cH:4][n:5][nH:6][c:7]2[cH:8][c:9]([C:11]#[N:12])[cH:10]1.[C:41]([O-:42])(=[O:43])[CH3:44].[C:46]([O-:47])(=[O:48])[CH3:49].[Cl:38][CH2:39][Cl:40].[Cu+2:45].[F:13][c:14]1[cH:15][c:16]([B:29]([OH:30])[OH:31])[cH:17][c:18]([F:28])[c:19]1[O:20][CH2:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[cH:32]1[cH:33][cH:34][n:35][cH:36][cH:37]1>>[Br:1][c:2]1[c:3]2[cH:4][n:5][n:6](-[c:16]3[cH:15][c:14]([F:13])[c:19]([O:20][CH2:21][c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)[c:18]([F:28])[cH:17]3)[c:7]2[cH:8][c:9]([C:11]#[N:12])[cH:10]1