HRID2329977

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6101

4-Methylbenzenesulfonic acid

C7H8O3S

HCID6365

1,1-Dichloroethane

C2H4Cl2

HCID15806

3-Hydroxy-3-phenyl-1,3-dihydroindol-2-one

C14H11NO2

结构：Cc1ccc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1O

HCID838083

未命名化合物

PRODUCTS

生成物

结构：Cc1cc(C2(c3ccccc3)C(=O)Nc3ccccc32)c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1O

HCID10414540

4-Tert-Butyl-N-(5-Hydroxy-4-Methyl-2-(2-Oxo-3-Phenylindolin-3-Yl)Phenyl)Benzenesulfonamide

C31H30N2O4S

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-705c7663f930409aa5fd0fea0709d227
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:18]([CH3:19])([CH3:20])([CH3:21])[c:22]1[cH:23][cH:24][c:25]([S:28](=[O:29])(=[O:30])[NH:31][c:32]2[cH:33][c:34]([OH:39])[c:35]([CH3:38])[cH:36][cH:37]2)[cH:26][cH:27]1.[Cl:51][CH:52]([Cl:53])[CH3:54].[OH:1][C:2]1([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[C:3](=[O:11])[NH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21.[c:40]1([CH3:41])[cH:42][cH:43][c:44]([S:45]([OH:46])(=[O:47])=[O:48])[cH:49][cH:50]1>>[C:2]1([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)([c:37]2[c:32]([NH:31][S:28]([c:25]3[cH:24][cH:23][c:22]([C:18]([CH3:19])([CH3:20])[CH3:21])[cH:27][cH:26]3)(=[O:29])=[O:30])[cH:33][c:34]([OH:39])[c:35]([CH3:38])[cH:36]2)[C:3](=[O:11])[NH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21