HRID2149431

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID1049

Pyridine

C5H5N

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID65578

Ethanedioyl dichloride

C2Cl2O2

HCID13044638

未命名化合物

结构：COC(=O)C(NS(=O)(=O)c1ccc(-c2ccc(N)cc2)cc1)C(C)C

HCID66909162

未命名化合物

PRODUCTS

生成物

结构：COC(=O)C(NS(=O)(=O)c1ccc(-c2ccc(NC(=O)c3oc4cccc(OC)c4c3C)cc2)cc1)C(C)C

HCID68715369

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-42605aed703347e8af2ac72a94ffa06b
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (4/10)

反应 SMILES

[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][c:7]2[c:8]1[c:9]([CH3:15])[c:10]([C:12](=[O:13])[OH:14])[o:11]2.[CH3:27][O:28][C:29]([CH:30]([CH:31]([CH3:32])[CH3:33])[NH:34][S:35](=[O:36])(=[O:37])[c:38]1[cH:39][cH:40][c:41](-[c:44]2[cH:45][cH:46][c:47]([NH2:50])[cH:48][cH:49]2)[cH:42][cH:43]1)=[O:51].[Cl:16][C:17]([C:18]([Cl:19])=[O:20])=[O:21].[O:22]=[CH:23][N:24]([CH3:25])[CH3:26].[cH:52]1[cH:53][cH:54][n:55][cH:56][cH:57]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][cH:6][c:7]2[c:8]1[c:9]([CH3:15])[c:10]([C:12](=[O:14])[NH:50][c:47]1[cH:46][cH:45][c:44](-[c:41]3[cH:40][cH:39][c:38]([S:35]([NH:34][CH:30]([C:29]([O:28][CH3:27])=[O:51])[CH:31]([CH3:32])[CH3:33])(=[O:36])=[O:37])[cH:43][cH:42]3)[cH:49][cH:48]1)[o:11]2