Acetic Acid → 1-(3-((5,7-Difluoroquinolin-6-yl)methyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethanone
Reaction equation
[C:29]([OH:30])(=[O:31])[CH3:32].[CH2:2]([CH3:3])[O:4][C:5](=[CH2:6])[c:7]1[cH:8][cH:9][c:10]2[n:11]([n:12]1)[c:13]([CH2:16][c:17]1[c:18]([F:28])[c:19]3[cH:20][cH:21][cH:22][n:23][c:24]3[cH:25][c:26]1[F:27])[n:14][n:15]2.[ClH:1]>>[O:4]=[C:5]([CH3:6])[c:7]1[cH:8][cH:9][c:10]2[n:11]([n:12]1)[c:13]([CH2:16][c:17]1[c:18]([F:28])[c:19]3[cH:20][cH:21][cH:22][n:23][c:24]3[cH:25][c:26]1[F:27])[n:14][n:15]2Participants
4
Sources & evidence
- ORD record
- ord-d4d3f368df5e4537af44cf5158ca4b40
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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