HRID680498

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

HCID23978

Copper

HCID104967

Cesium(1+)

Cs+

2 次

HCID221126

2-iodo-pyridine

C5H4IN

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(Oc3ccccn3)cc2n1Cc1ccccn1

HCID59762396

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-796c16e705a74c9fa09869915ae4c940
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:33](=[O:34])([O-:35])[O-:36].[CH3:46][N:47]([CH3:48])[CH:49]=[O:50].[Cs+:37].[Cs+:38].[Cu:51].[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].[I:39][c:40]1[n:41][cH:42][cH:43][cH:44][cH:45]1>>[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:40]4[n:41][cH:42][cH:43][cH:44][cH:45]4)[cH:15][cH:16][c:17]23)[cH:29][cH:30][c:31]1[F:32]