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

HRID 2329977Notes

Reaction equation

HRID 2329977 reaction equation
[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

Participants

5

Reactant 4

HCID 6101p-Toluenesulfonic acidHCID 63651,1-DichloroethaneHCID 158063-Hydroxy-3-phenyl-1,3-dihydroindol-2-oneHCID 8380834-tert-butyl-N-(3-hydroxy-4-methylphenyl)benzenesulfonamide

Product 1

HCID 104145404-Tert-Butyl-N-(5-Hydroxy-4-Methyl-2-(2-Oxo-3-Phenylindolin-3-Yl)Phenyl)Benzenesulfonamide

Sources & evidence

ORD record
ord-705c7663f930409aa5fd0fea0709d227
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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