Hydrochloric Acid → 4-[6-(5-Chloro-2-fluoro-phenyl)-3-methyl-isoxazolo[5,4-d]pyrimidin-4-ylamino]-nicotinic acid
Reaction equation
[CH3:1][O:2][C:3]([c:4]1[cH:5][n:6][cH:7][cH:8][c:9]1[NH:10][c:11]1[c:12]2[c:13]([n:14][c:15](-[c:17]3[c:18]([F:24])[cH:19][cH:20][c:21]([Cl:23])[cH:22]3)[n:16]1)[o:25][n:26][c:27]2[CH3:28])=[O:29].[CH3:33][OH:34].[ClH:32].[Na+:31].[OH-:30]>>[O:2]=[C:3]([c:4]1[cH:5][n:6][cH:7][cH:8][c:9]1[NH:10][c:11]1[c:12]2[c:13]([n:14][c:15](-[c:17]3[c:18]([F:24])[cH:19][cH:20][c:21]([Cl:23])[cH:22]3)[n:16]1)[o:25][n:26][c:27]2[CH3:28])[OH:29]Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-9e0ad0cbe2c84961b4328faa7ebe227b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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