Tetrapropylammonium → 4-{1-[4-(3,3-dimethyl-2-oxobutoxy)-3-methylphenyl]-1-ethylpropyl}-N-(2-methanesulfonylethyl)-2-methylbenzamide

HRID 172468Notes

Reaction equation

HRID 172468 reaction equation
[CH2:1]([CH3:2])[C:3]([CH2:4][CH3:5])([c:6]1[cH:7][c:8]([CH3:20])[c:9]([O:12][CH2:13][CH:14]([C:15]([CH3:16])([CH3:17])[CH3:18])[OH:19])[cH:10][cH:11]1)[c:21]1[cH:22][c:23]([CH3:36])[c:24]([C:25](=[O:26])[NH:27][CH2:28][CH2:29][S:30](=[O:31])(=[O:32])[CH3:33])[cH:34][cH:35]1.[CH3:37][N+:38]1([O-:39])[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1.[CH3:45][CH2:46][CH2:47][N+:48]([CH2:49][CH2:50][CH3:51])([CH2:52][CH2:53][CH3:54])[CH2:55][CH2:56][CH3:57].[O:58]=[Ru:59](=[O:60])([O-:61])=[O:62]>>[CH2:1]([CH3:2])[C:3]([CH2:4][CH3:5])([c:6]1[cH:7][c:8]([CH3:20])[c:9]([O:12][CH2:13][C:14]([C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[cH:10][cH:11]1)[c:21]1[cH:22][c:23]([CH3:36])[c:24]([C:25](=[O:26])[NH:27][CH2:28][CH2:29][S:30](=[O:31])(=[O:32])[CH3:33])[cH:34][cH:35]1

Participants

5

Reactant 4

HCID 9559TetrapropylammoniumHCID 82029Methyl morpholine oxideHCID 577634394-{1-ethyl-1-[4-(2-hydroxy-3,3-dimethylbutoxy)-3-methylphenyl]propyl}-N-(2-methanesulfonylethyl)-2-methylbenzamideHCID 178527104HCID 178527104, compound

Product 1

HCID 103692604-{1-[4-(3,3-dimethyl-2-oxobutoxy)-3-methylphenyl]-1-ethylpropyl}-N-(2-methanesulfonylethyl)-2-methylbenzamide

Sources & evidence

ORD record
ord-b5f9547cc9f54adc947ac7e98cdb0d30
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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