HRID958785

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID69873

4-Phenylpiperidine

C11H15N

HCID81531

Diisopropylethylamine

C8H19N

结构：O=C1CCC(N2C(=O)c3cccc(OCc4ccc(CBr)cc4)c3C2=O)C(=O)N1

HCID67334102

未命名化合物

PRODUCTS

生成物

结构：O=C1CCC(N2C(=O)c3cccc(OCc4ccc(CN5CCC(c6ccccc6)CC5)cc4)c3C2=O)C(=O)N1

HCID58389168

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-dfbfa356622f4cdcb0be553f948b7364
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:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][O:8][c:9]2[c:10]3[c:14]([cH:15][cH:16][cH:17]2)[C:13](=[O:18])[N:12]([CH:19]2[C:20](=[O:26])[NH:21][C:22](=[O:25])[CH2:23][CH2:24]2)[C:11]3=[O:27])[cH:28][cH:29]1.[CH3:51][C:52]#[N:53].[CH:42]([N:43]([CH2:44][CH3:45])[CH:46]([CH3:47])[CH3:48])([CH3:49])[CH3:50].[c:30]1([CH:36]2[CH2:37][CH2:38][NH:39][CH2:40][CH2:41]2)[cH:31][cH:32][cH:33][cH:34][cH:35]1>>[CH2:2]([c:3]1[cH:4][cH:5][c:6]([CH2:7][O:8][c:9]2[c:10]3[c:14]([cH:15][cH:16][cH:17]2)[C:13](=[O:18])[N:12]([CH:19]2[C:20](=[O:26])[NH:21][C:22](=[O:25])[CH2:23][CH2:24]2)[C:11]3=[O:27])[cH:28][cH:29]1)[N:39]1[CH2:38][CH2:37][CH:36]([c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[CH2:41][CH2:40]1