Sodium ion → 2-[benzothiazol-2(3H)-ylidene]-2-[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]acetamide
Reaction equation
[Na+:28].[OH-:27].[S:1]1[C:2](=[C:10]([C:11]#[N:12])[c:13]2[n:14][c:15]([C:23]([F:24])([F:25])[F:26])[cH:16][c:17]([C:19]([CH3:20])([CH3:21])[CH3:22])[n:18]2)[NH:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2.[S:29](=[O:30])(=[O:31])([OH:32])[OH:33]>>[S:1]1[C:2](=[C:10]([C:11]([NH2:12])=[O:27])[c:13]2[n:14][c:15]([C:23]([F:24])([F:25])[F:26])[cH:16][c:17]([C:19]([CH3:20])([CH3:21])[CH3:22])[n:18]2)[NH:3][c:4]2[c:5]1[cH:6][cH:7][cH:8][cH:9]2Participants
5
Sources & evidence
- ORD record
- ord-71db349890a54f3b90e8a5a214d50568
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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