HRID215169

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6342

Acetonitrile

C2H3N

HCID6344

Dichloromethane

CH2Cl2

HCID81531

Diisopropylethylamine

C8H19N

HCID12763911

4-(3-Methylphenyl)piperidine

C12H17N

结构：O=C1CCC(N2Cc3c(OCc4ccc(CBr)cc4)cccc3C2=O)C(=O)N1

HCID58389196

未命名化合物

PRODUCTS

生成物

结构：Cc1cccc(C2CCN(Cc3ccc(COc4cccc5c4CN(C4CCC(=O)NC4=O)C5=O)cc3)CC2)c1

HCID67333401

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f7f347750ee942988312872a96770ed3
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (6/10)

反应 SMILES

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