HRID947881

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：OB(O)c1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)nc1C(F)(F)F

HCID22032227

未命名化合物

结构：O=C(NCc1ccc(F)cc1)C1CCN(c2ccnc3ccc(Br)cc23)CC1

HCID86760173

未命名化合物

PRODUCTS

生成物

结构：O=C(NCc1ccc(F)cc1)C1CCN(c2ccnc3ccc(-c4cn(C(c5ccccc5)(c5ccccc5)c5ccccc5)nc4C(F)(F)F)cc23)CC1

HCID86760172

1-[6-(3-trifluoromethyl-1-trityl-1H-pyrazol-4-yl)quinolin-4-yl]-piperidine-4-carboxylic acid (4-fluorophenyl)methylamide

C45H37F4N5O

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-fb506b8cc64641ab972981eede462788
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

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