Acetate → 2-N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-N-[1-(4-fluorophenyl)ethyl]pyridine-2,3,6-triamine
Reaction equation
[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:32][C:33](=[O:34])[O-:35].[CH3:36][OH:37].[CH:1]1([c:4]2[cH:5][c:6]([NH:9][c:10]3[n:11][c:12]([NH:19][CH:20]([CH3:21])[c:22]4[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]4)[cH:13][cH:14][c:15]3[N+:16]([O-:17])=[O:18])[n:7][nH:8]2)[CH2:2][CH2:3]1.[Cl-:29].[NH4+:30].[NH4+:31].[Zn:43]>>[CH:1]1([c:4]2[cH:5][c:6]([NH:9][c:10]3[n:11][c:12]([NH:19][CH:20]([CH3:21])[c:22]4[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]4)[cH:13][cH:14][c:15]3[NH2:16])[n:7][nH:8]2)[CH2:2][CH2:3]1Participants
8
Sources & evidence
- ORD record
- ord-905138e0954c4f5da31457b345aa6c43
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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