Water → N-[[2-oxo-3-[1-oxo-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-7-yl]-1,3-oxazolidin-5-yl]methyl]methanesulfonamide

HRID 689130Notes

Reaction equation

HRID 689130 reaction equation
[CH2:42]([Cl:43])[Cl:44].[CH3:36][S:37]([Cl:38])(=[O:39])=[O:40].[NH2:1][CH2:2][CH:3]1[CH2:4][N:5]([c:9]2[cH:10][cH:11][c:12]3[cH:13][c:14](-[c:20]4[c:21]([C:26]([F:27])([F:28])[F:29])[cH:22][cH:23][cH:24][cH:25]4)[nH:15][c:16](=[O:19])[c:17]3[cH:18]2)[C:6](=[O:8])[O:7]1.[OH2:41].[cH:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1>>[NH:1]([CH2:2][CH:3]1[CH2:4][N:5]([c:9]2[cH:10][cH:11][c:12]3[cH:13][c:14](-[c:20]4[c:21]([C:26]([F:27])([F:28])[F:29])[cH:22][cH:23][cH:24][cH:25]4)[nH:15][c:16](=[O:19])[c:17]3[cH:18]2)[C:6](=[O:8])[O:7]1)[S:37]([CH3:36])(=[O:39])=[O:40]

Participants

6

Reactant 5

HCID 962WaterHCID 1049PyridineHCID 6344DichloromethaneHCID 31297Methanesulfonyl chlorideHCID 118541927-(5-aminomethyl-2-oxooxazolidin-3-yl)-3-(2-trifluoromethylphenyl)-2H-isoquinolin-1-one

Product 1

HCID 68684945N-[[2-oxo-3-[1-oxo-3-[2-(trifluoromethyl)phenyl]-2H-isoquinolin-7-yl]-1,3-oxazolidin-5-yl]methyl]methanesulfonamide

Sources & evidence

ORD record
ord-e16bf934a29643e09a381bb905f0cee3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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