HRID685584

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID31374

Dimethylacetamide

C4H9NO

HCID81503

Bromomethylcyclopropane

C4H7Br

HCID81531

Diisopropylethylamine

C8H19N

HCID10905217

未命名化合物

PRODUCTS

生成物

结构：CN(CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)cc1)CC1CC1

HCID11059310

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c6f8ea31f99b48e9a24fdb39486b9979
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (3/10)

反应 SMILES

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