Valinol → N-(1-hydroxy-3-methylbutan-2-yl)-6-[4-[3-(propan-2-ylamino)-2-pyridinyl]piperazine-1-carbonyl]pyridine-3-carboxamide
Reaction equation
[CH:1]([CH3:2])([CH3:3])[NH:4][c:5]1[c:6]([N:11]2[CH2:12][CH2:13][N:14]([C:17](=[O:18])[c:19]3[n:20][cH:21][c:22]([C:23](=[O:24])[OH:25])[cH:26][cH:27]3)[CH2:15][CH2:16]2)[n:7][cH:8][cH:9][cH:10]1.[NH2:28][CH:29]([CH2:30][OH:31])[CH:32]([CH3:33])[CH3:34]>>[CH:1]([CH3:2])([CH3:3])[NH:4][c:5]1[c:6]([N:11]2[CH2:12][CH2:13][N:14]([C:17](=[O:18])[c:19]3[n:20][cH:21][c:22]([C:23](=[O:24])[NH:28][CH:29]([CH2:30][OH:31])[CH:32]([CH3:33])[CH3:34])[cH:26][cH:27]3)[CH2:15][CH2:16]2)[n:7][cH:8][cH:9][cH:10]1Participants
3
Sources & evidence
- ORD record
- ord-bd938df36b8849498f3942eb519ed000
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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