5,5-Dimethyloxazolin-2-one → 3-{3-(1,1-Dioxoisothiazolidin-2-yl)-4-[4-(5-ethyl-3-methylpyridin-2-yl)piperazine-1-carbonyl]phenyl}-5,5-dimethyloxazolidin-2-one

HRID 120938Notes

Reaction equation

HRID 120938 reaction equation
[Br:1][c:2]1[cH:3][c:4]([N:25]2[S:26](=[O:30])(=[O:31])[CH2:27][CH2:28][CH2:29]2)[c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][N:13]([c:16]3[n:17][cH:18][c:19]([CH2:23][CH3:24])[cH:20][c:21]3[CH3:22])[CH2:14][CH2:15]2)[cH:6][cH:7]1.[CH3:32][C:33]1([CH3:39])[CH:34]=[N:35][C:36](=[O:38])[O:37]1>>[c:2]1([N:35]2[CH2:34][C:33]([CH3:32])([CH3:39])[O:37][C:36]2=[O:38])[cH:3][c:4]([N:25]2[S:26](=[O:30])(=[O:31])[CH2:27][CH2:28][CH2:29]2)[c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH2:12][N:13]([c:16]3[n:17][cH:18][c:19]([CH2:23][CH3:24])[cH:20][c:21]3[CH3:22])[CH2:14][CH2:15]2)[cH:6][cH:7]1

Participants

3

Reactant 2

HCID 214647825,5-Dimethyloxazolin-2-oneHCID 58484567[4-Bromo-2-(1,1-dioxoisothiazolidin-2-yl)phenyl][4-(5-ethyl-3-methylpyridin-2-yl)piperazin-1-yl]methanone

Product 1

HCID 584847203-{3-(1,1-Dioxoisothiazolidin-2-yl)-4-[4-(5-ethyl-3-methylpyridin-2-yl)piperazine-1-carbonyl]phenyl}-5,5-dimethyloxazolidin-2-one

Sources & evidence

ORD record
ord-b20ef2b989e9491fa20a37ad27c851ef
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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