HRID1239302

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

HCID961

Hydroxide

HO-

HCID12286

3-Bromopyridine

C5H4BrN

HCID23978

Copper

HCID31374

Dimethylacetamide

C4H9NO

结构：CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(O)cc2n1Cc1ccccn1

HCID59762365

未命名化合物

PRODUCTS

生成物

结构：CC(C)c1c(C(=O)NCc2ccc(F)c(F)c2)c2ccc(Oc3cccnc3)cc2n1Cc1ccccn1

HCID59762343

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b384c7bd15ac49c59a2174dea3a21b3c
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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