1-Butanol → methyl 4-hydroxy-7-methyl-1,1-dioxo-2H-1lambda6,2-benzothiazine-3-carboxylate

HRID 151556Notes

Reaction equation

HRID 151556 reaction equation
[CH2:46]([OH:47])[CH2:48][CH2:49][CH3:50].[CH3:14][N:15]1[C:16]([C:17]([NH:18][c:19]2[s:20][c:21]([CH3:22])[cH:23][n:24]2)=[O:25])=[C:26]([OH:27])[c:28]2[cH:29][c:30]([CH3:31])[cH:32][cH:33][c:34]2[S:35]1(=[O:36])=[O:37].[CH3:1][c:2]1[cH:3][c:4]2[c:5]([cH:12][cH:13]1)[C:6](=[O:11])[NH:7][S:8]2(=[O:9])=[O:10].[Cl:40][CH2:41][C:42](=[O:43])[O:44][CH3:45].[Na+:39].[OH-:38]>>[CH3:1][c:2]1[cH:3][c:4]2[c:5]([cH:12][cH:13]1)[C:6]([OH:11])=[C:41]([C:42](=[O:43])[O:44][CH3:45])[NH:7][S:8]2(=[O:9])=[O:10]

Participants

7

Reactant 6

HCID 2631-ButanolHCID 923Sodium ionHCID 961HydroxideHCID 7295Methyl chloroacetateHCID 3537946-MethylsaccharinHCID 546942212,6-Dimethyl-4-hydroxy-N-(5-methyl-2-thiazolyl)-2H-1,2-benzothiazine-3-carboxamide-1,1-dioxide

Product 1

HCID 54716828methyl 4-hydroxy-7-methyl-1,1-dioxo-2H-1lambda6,2-benzothiazine-3-carboxylate

Sources & evidence

ORD record
ord-e6b3cd0f0642445f899d1579d75398b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…