HRID1202795

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID813

Potassium cation

K+

2 次

HCID6228

N,N-Dimethylformamide

C3H7NO

HCID19660

Carbonate

CO3-2

结构：Cc1ccc(S(=O)(=O)Sc2cc(C)c(N)cc2C(C)(C)C)cc1

HCID10569823

未命名化合物

结构：O=C1C=C(O)CC(CCc2ccc(O)cc2)(CCc2ccc(O)cc2)O1

HCID54682265

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(SC2=C(O)CC(CCc3ccc(O)cc3)(CCc3ccc(O)cc3)OC2=O)c(C(C)(C)C)cc1N

HCID54682277

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-f5c600cbd821461a88560b56dfe3033c
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

[K+:50].[K+:51].[NH2:27][c:28]1[cH:29][c:30]([C:46]([CH3:47])([CH3:48])[CH3:49])[c:31]([S:35][S:36]([c:37]2[cH:38][cH:39][c:40]([CH3:41])[cH:42][cH:43]2)(=[O:44])=[O:45])[cH:32][c:33]1[CH3:34].[O-:52][C:53]([O-:54])=[O:55].[O:56]=[CH:57][N:58]([CH3:59])[CH3:60].[OH:1][C:2]1=[CH:3][C:4](=[O:26])[O:5][C:6]([CH2:8][CH2:9][c:10]2[cH:11][cH:12][c:13]([OH:16])[cH:14][cH:15]2)([CH2:17][CH2:18][c:19]2[cH:20][cH:21][c:22]([OH:25])[cH:23][cH:24]2)[CH2:7]1>>[OH:1][C:2]1=[C:3]([S:35][c:31]2[c:30]([C:46]([CH3:47])([CH3:48])[CH3:49])[cH:29][c:28]([NH2:27])[c:33]([CH3:34])[cH:32]2)[C:4](=[O:26])[O:5][C:6]([CH2:8][CH2:9][c:10]2[cH:11][cH:12][c:13]([OH:16])[cH:14][cH:15]2)([CH2:17][CH2:18][c:19]2[cH:20][cH:21][c:22]([OH:25])[cH:23][cH:24]2)[CH2:7]1