HRID1219203

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID4266884

Phenylmethyl 2-(3-hydroxy-1-propen-1-yl)-1-pyrrolidinecarboxylate

C15H19NO3

结构：CNS(=O)(=O)Cc1ccc(NC(=O)C(F)(F)F)c(Br)c1

HCID11003296

未命名化合物

PRODUCTS

生成物

结构：CNS(=O)(=O)Cc1ccc(N(CC=CC2CCCN2C(=O)OCc2ccccc2)C(=O)C(F)(F)F)c(Br)c1

HCID57190584

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-560b373c7bd8496395f3a8d69ea5fa10
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (5/10)

反应 SMILES

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