Acetic Acid → 5-Amino-6-fluoro-3-methyl-1,2-benzisothiazole
Reaction equation
[CH3:15][C:16](=[O:17])[OH:18].[CH3:20][CH2:21][O:22][C:23](=[O:24])[CH3:25].[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH3:9])[n:7][s:8]2)[cH:10][c:11]1[N+:12]([O-:13])=[O:14].[Fe:19]>>[F:1][c:2]1[cH:3][c:4]2[c:5]([c:6]([CH3:9])[n:7][s:8]2)[cH:10][c:11]1[NH2:12]Participants
5
Sources & evidence
- ORD record
- ord-20c48f9ddcbd4916b918cc1586796d2c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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