HRID961481

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID12286

3-Bromopyridine

C5H4BrN

HCID3697076

8-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1,4-dioxaspiro[4.5]dec-7-ene

C14H23BO4

HCID20034907

4-(Pyridin-3-yl)cyclohexan-1-one

C11H13NO

结构：O=C(CNc1ncnc2ccc(C(F)(F)F)cc12)NC1CNC1

HCID68003594

未命名化合物

PRODUCTS

生成物

结构：O=C(CNc1ncnc2ccc(C(F)(F)F)cc12)NC1CN(C2CCC(c3cccnc3)CC2)C1

HCID54772203

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-9996398f808843e59dfa0e571195ac57
来源数据集: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Validation data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

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