3,5-Dimethylisoxazole-4-sulfonyl chloride → 3,5-Dimethylisoxazole-4-sulfonic acid

HRID 1239922Notes

Reaction equation

HRID 1239922 reaction equation
[CH2:1]([c:2]1[cH:3][c:4]([CH:5]([NH:6][S:7]([c:8]2[cH:9][cH:10][c:11]([F:12])[c:13]([F:15])[cH:16]2)(=[O:14])=[O:17])[CH3:18])[cH:19][cH:20][c:21]1-[c:22]1[cH:23][c:24]([F:25])[cH:26][cH:27][c:28]1[O:29][CH3:30])[CH:31]=[CH2:32].[CH3:50][c:51]1[n:52][o:53][c:54]([CH3:60])[c:55]1[S:56](=[O:57])(=[O:58])[Cl:59].[F:33][c:34]1[cH:35][c:36](-[c:42]2[cH:43][cH:44][c:45]([CH2:46][NH2:47])[cH:48][cH:49]2)[c:37]([O:40][CH3:41])[n:38][cH:39]1>>[F:33][c:34]1[cH:35][c:36](-[c:42]2[cH:43][cH:44][c:45]([CH2:46][NH-:47])[cH:48][cH:49]2)[c:37]([O:40][CH3:41])[n:38][cH:39]1.[OH:14][S:56]([c:55]1[c:51]([CH3:50])[n:52][o:53][c:54]1[CH3:60])(=[O:57])=[O:58]

Participants

5

Reactant 3

HCID 27363193,5-Dimethylisoxazole-4-sulfonyl chlorideHCID 672449154-(5-Fluoro-2-methoxy-pyridin-3-yl)-benzylamineHCID 67245690N-[1-(2-allyl-5'-fluoro-2'-methoxy-biphenyl-4-yl)-ethyl]-3,4-difluoro-benzenesulfonamide

Product 2

HCID 218647763,5-Dimethylisoxazole-4-sulfonic acidHCID 178494200HCID 178494200, compound

Sources & evidence

ORD record
ord-12d4b7bd540749efa58545fbe8782550
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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