HRID116655

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID598754

4-Methyl-2-piperazin-1-yl-quinoline

C14H17N3

结构：O=C(NCC(F)(F)F)C1(CCCCBr)c2ccccc2-c2ccccc21

HCID10526437

9-(4-Bromobutyl)-N-(2,2,2-trifluoroethyl)-9H-fluorene-9-carboxamide

C20H19BrF3NO

PRODUCTS

生成物

结构：Cc1cc(N2CCN(CCCCC3(C(=O)NCC(F)(F)F)c4ccccc4-c4ccccc43)CC2)nc2ccccc12

HCID22636172

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-3115d7f9e48a4a9b92314f7ca3bbd44f
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

[CH3:27][c:28]1[cH:29][c:30]([N:38]2[CH2:39][CH2:40][NH:41][CH2:42][CH2:43]2)[n:31][c:32]2[cH:33][cH:34][cH:35][cH:36][c:37]12.[F:1][C:2]([CH2:3][NH:4][C:5](=[O:6])[C:7]1([CH2:20][CH2:21][CH2:22][CH2:23][Br:24])[c:8]2[cH:9][cH:10][cH:11][cH:12][c:13]2-[c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]21)([F:25])[F:26]>>[F:1][C:2]([CH2:3][NH:4][C:5](=[O:6])[C:7]1([CH2:20][CH2:21][CH2:22][CH2:23][N:41]2[CH2:40][CH2:39][N:38]([c:30]3[cH:29][c:28]([CH3:27])[c:37]4[c:32]([n:31]3)[cH:33][cH:34][cH:35][cH:36]4)[CH2:43][CH2:42]2)[c:8]2[cH:9][cH:10][cH:11][cH:12][c:13]2-[c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]21)([F:25])[F:26]