2,6-Difluorobenzenesulfonyl chloride → N-{3-[5-(2-chloro-4-pyrimidinyl)-2-(1,1-dimethylethyl)-1,3-oxazol-4-yl]-2-fluorophenyl}-2,6-difluorobenzenesulfonamide

HRID 165203Notes

Reaction equation

HRID 165203 reaction equation
[Cl:1][c:2]1[n:3][c:4](-[c:5]2[s:6][c:7]([CH:8]([CH3:9])[CH3:10])[n:11][c:12]2-[c:13]2[cH:14][c:15]([NH:16][S:23](=[O:24])(=[O:25])[c:26]3[c:27]([F:33])[cH:28][cH:29][cH:30][c:31]3[F:32])[cH:17][cH:18][cH:19]2)[cH:20][cH:21][n:22]1.[Cl:34][c:35]1[n:36][cH:37][cH:38][c:39](-[c:41]2[c:42](-[c:50]3[c:51]([F:57])[c:52]([NH2:53])[cH:54][cH:55][cH:56]3)[n:43][c:44]([C:46]([CH3:47])([CH3:48])[CH3:49])[o:45]2)[n:40]1.[F:58][c:59]1[cH:60][cH:61][cH:62][c:63]([F:64])[c:65]1[S:66]([Cl:67])(=[O:68])=[O:69]>>[S:23](=[O:24])(=[O:25])([c:26]1[c:27]([F:33])[cH:28][cH:29][cH:30][c:31]1[F:32])[NH:53][c:52]1[c:51]([F:57])[c:50](-[c:42]2[c:41](-[c:39]3[cH:38][cH:37][n:36][c:35]([Cl:34])[n:40]3)[o:45][c:44]([C:46]([CH3:47])([CH3:48])[CH3:49])[n:43]2)[cH:56][cH:55][cH:54]1

Participants

4

Reactant 3

HCID 27342712,6-Difluorobenzenesulfonyl chlorideHCID 579899403-[5-(2-Chloro-4-pyrimidinyl)-2-(1,1-dimethylethyl)-1,3-oxazol-4-yl]-2-fluoroanilineHCID 57990030N-{3-[5-(2-chloro-4-pyrimidinyl)-2-(1-methylethyl)-1,3-thiazol-4-yl]phenyl}-2,6-difluorobenzenesulfonamide

Product 1

HCID 57989681N-{3-[5-(2-chloro-4-pyrimidinyl)-2-(1,1-dimethylethyl)-1,3-oxazol-4-yl]-2-fluorophenyl}-2,6-difluorobenzenesulfonamide

Sources & evidence

ORD record
ord-c9fa7553b77f45c1b0229762cdd05ede
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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