HRID2349018

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：COc1ccc(S(=O)(=O)N2CC=CCC(CO)C2C(=O)OC(C)(C)C)cc1

HCID53896843

未命名化合物

结构：COc1ccc(S(=O)(=O)N2CCCCC(CSc3ccccc3)C2C(=O)OC(C)(C)C)cc1

HCID54310094

未命名化合物

PRODUCTS

生成物

HCID54009864

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-49601c2d42c34f868be0340750f3f951
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

[C:1]([O:2][C:3]([CH:4]1[CH:5]([CH2:6][OH:7])[CH2:8][CH:9]=[CH:10][CH2:11][N:12]1[S:13]([c:14]1[cH:15][cH:16][c:17]([O:18][CH3:19])[cH:20][cH:21]1)(=[O:22])=[O:23])=[O:24])([CH3:25])([CH3:26])[CH3:27].[C:28]([CH3:29])([CH3:30])([CH3:31])[O:32][C:33](=[O:34])[CH:35]1[N:36]([S:50](=[O:51])(=[O:52])[c:53]2[cH:54][cH:55][c:56]([O:59][CH3:60])[cH:57][cH:58]2)[CH2:37][CH2:38][CH2:39][CH2:40][CH:41]1[CH2:42][S:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[C:28]([CH3:29])([CH3:30])([CH3:31])[O:32][C:33](=[O:34])[CH:35]1[N:36]([S:50](=[O:51])(=[O:52])[c:53]2[cH:54][cH:55][c:56]([O:59][CH3:60])[cH:57][cH:58]2)[CH2:37][CH:38]=[CH:39][CH2:40][CH:41]1[CH2:42][S:43][c:44]1[cH:45][cH:46][cH:47][cH:48][cH:49]1