HRID2145737

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID11601416

未命名化合物

PRODUCTS

产物

HCID10178035

未命名化合物

HCID22329493

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-eae737db4bc74b2abdf35b9cbd1714f9
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应SMILES

[Br:1][c:2]1[cH:3][cH:4][c:5]([F:16])[c:6](-[c:8]2[c:9]([C:10]#[N:11])[cH:12][cH:13][cH:14][n:15]2)[cH:7]1.[Br:58][c:59]1[cH:60][n:61][c:62]2[n:63]1[n:64][cH:65][c:66]([C:68]([F:69])([F:70])[F:71])[n:67]2.[C:40]([c:41]1[c:42](-[c:43]2[cH:44][c:45]([B:46]([OH:47])[OH:48])[cH:49][cH:50][c:51]2[F:52])[n:53][cH:54][cH:55][cH:56]1)#[N:57].[CH3:17][C:18]1([CH3:39])[CH2:19][O:20][B:21]([c:24]2[cH:25][cH:26][c:27]([F:38])[c:28](-[c:30]3[c:31]([C:32]#[N:33])[cH:34][cH:35][cH:36][n:37]3)[cH:29]2)[O:22][CH2:23]1>>[CH3:17][C:18]1([CH3:39])[CH2:19][O:20][B:21]([c:24]2[cH:25][cH:26][c:27]([F:38])[c:28](-[c:30]3[c:31]([C:32]#[N:33])[cH:34][cH:35][cH:36][n:37]3)[cH:29]2)[O:22][CH2:23]1.[c:2]1(-[c:59]2[cH:60][n:61][c:62]3[n:63]2[n:64][cH:65][c:66]([C:68]([F:69])([F:70])[F:71])[n:67]3)[cH:3][cH:4][c:5]([F:16])[c:6](-[c:8]2[c:9]([C:10]#[N:11])[cH:12][cH:13][cH:14][n:15]2)[cH:7]1