HRID1237906

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID2756555

5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine

C11H17BN2O2

结构：Cc1nc(Br)cn1-c1nc(-c2ccc(C(F)(F)F)cc2)cc(C(F)(F)F)n1

HCID57468774

未命名化合物

PRODUCTS

生成物

结构：Cc1nc(-c2ccc(N)nc2)cn1-c1nc(-c2ccc(C(F)(F)F)cc2)cc(C(F)(F)F)n1

HCID60209412

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-2c4812f5155b4e94b2fbb679e9b4c885
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:1][c:2]1[n:3][c:4]([CH3:27])[n:5](-[c:7]2[n:8][c:9](-[c:17]3[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]3)[cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[n:12]2)[cH:6]1.[NH2:28][c:29]1[n:30][cH:31][c:32]([B:35]2[O:36][C:37]([CH3:38])([CH3:39])[C:40]([CH3:41])([CH3:42])[O:43]2)[cH:33][cH:34]1>>[c:2]1(-[c:32]2[cH:31][n:30][c:29]([NH2:28])[cH:34][cH:33]2)[n:3][c:4]([CH3:27])[n:5](-[c:7]2[n:8][c:9](-[c:17]3[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[cH:21][cH:22]3)[cH:10][c:11]([C:13]([F:14])([F:15])[F:16])[n:12]2)[cH:6]1