HRID99182

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CC1(C)OB(c2ccc(F)c(-c3cccnc3)c2)OC1(C)C

HCID11426523

3-[2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine

C17H19BFNO2

HCID11601416

未命名化合物

结构：CC1(C)OB(c2ccc(F)c(-c3ccccc3S(C)(=O)=O)c2)OC1(C)C

HCID22285323

未命名化合物

PRODUCTS

生成物

结构：CS(=O)(=O)c1ccccc1-c1cc(-c2cnc3nc(C(F)(F)F)cnn23)ccc1F

HCID10160169

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-81d570cbeed34007a97d7846bcac8e12
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

[Br:1][c:2]1[cH:3][n:4][c:5]2[n:6]1[n:7][cH:8][c:9]([C:11]([F:12])([F:13])[F:14])[n:10]2.[F:15][c:16]1[cH:17][cH:18][c:19]([B:32]2[O:33][C:34]([CH3:35])([CH3:36])[C:37]([CH3:38])([CH3:39])[O:40]2)[cH:20][c:21]1-[c:22]1[c:23]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:24][cH:25][cH:26][cH:27]1.[F:41][c:42]1[cH:43][cH:44][c:45]([B:46]2[O:47][C:48]([CH3:49])([CH3:50])[C:51]([CH3:52])([CH3:53])[O:54]2)[cH:55][c:56]1-[c:57]1[cH:58][n:59][cH:60][cH:61][cH:62]1>>[c:2]1(-[c:19]2[cH:18][cH:17][c:16]([F:15])[c:21](-[c:22]3[c:23]([S:28](=[O:29])(=[O:30])[CH3:31])[cH:24][cH:25][cH:26][cH:27]3)[cH:20]2)[cH:3][n:4][c:5]2[n:6]1[n:7][cH:8][c:9]([C:11]([F:12])([F:13])[F:14])[n:10]2