HRID2345539

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID31268

Pyrrolidine

C4H9N

HCID31374

Dimethylacetamide

C4H9NO

结构：CN(CC1CCC(COCCCCBr)CC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1

HCID22294178

未命名化合物

PRODUCTS

生成物

结构：CN(CC1CCC(COCCCCN2CCCC2)CC1)S(=O)(=O)c1ccc(C(F)(F)F)cc1

HCID22294151

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-b24502f88cc34379aa588c0618cd0186
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (10/10)

反应 SMILES

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