Acetone → 4-[(2-Methoxycarbonyl-2-methylpropionyloxy)-methoxy]-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine-3-carboxamide 1,1-Dioxide

HRID 293014Notes

Reaction equation

HRID 293014 reaction equation
[Br-:42].[C:24](=[O:25])([O-:26])[O-:27].[CH3:1][N:2]1[C:3]([C:4](=[O:5])[NH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][n:12]2)=[C:13]([OH:14])[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[S:21]1(=[O:22])=[O:23].[CH3:30][C:31]([C:32](=[O:33])[O:34][CH2:35][I:36])([C:37](=[O:38])[O:39][CH3:40])[CH3:41].[CH3:44][C:45](=[O:46])[CH3:47].[K+:28].[K+:29].[K+:43]>>[CH3:1][N:2]1[C:3]([C:4](=[O:5])[NH:6][c:7]2[cH:8][cH:9][cH:10][cH:11][n:12]2)=[C:13]([O:14][CH2:35][O:34][C:32]([C:31]([CH3:30])([C:37](=[O:38])[O:39][CH3:40])[CH3:41])=[O:33])[c:15]2[cH:16][cH:17][cH:18][cH:19][c:20]2[S:21]1(=[O:22])=[O:23]

Participants

7

Reactant 6

HCID 180AcetoneHCID 259Bromide ionHCID 813Potassium Cation3×HCID 19660Carbonate IonHCID 20260333Iodomethyl methyl 2,2-dimethylmalonateHCID 54676228Piroxicam

Product 1

HCID 135066664-[(2-Methoxycarbonyl-2-methylpropionyloxy)-methoxy]-2-methyl-N-(2-pyridyl)-2H-1,2-benzothiazine-3-carboxamide 1,1-Dioxide

Sources & evidence

ORD record
ord-e0e17b85410e4376a6b519f88e6275d5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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