Water → 3-(5-(4-(Difluoromethoxy)phenyl)pyrimidin-2-ylamino)benzyl methanesulfonate
Reaction equation
[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[CH3:33][S:34]([Cl:35])(=[O:36])=[O:37].[Cl:38][CH2:39][Cl:40].[F:1][CH:2]([O:3][c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][n:12][c:13]([NH:16][c:17]3[cH:18][c:19]([CH2:23][OH:24])[cH:20][cH:21][cH:22]3)[n:14][cH:15]2)[cH:8][cH:9]1)[F:25].[OH2:41]>>[F:1][CH:2]([O:3][c:4]1[cH:5][cH:6][c:7](-[c:10]2[cH:11][n:12][c:13]([NH:16][c:17]3[cH:18][c:19]([CH2:23][O:24][S:34]([CH3:33])(=[O:36])=[O:37])[cH:20][cH:21][cH:22]3)[n:14][cH:15]2)[cH:8][cH:9]1)[F:25]Participants
6
Sources & evidence
- ORD record
- ord-3c71fd8f479f477eaebea6ca784e2cc8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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