Isopropanol → 5-Bromo-4-(4-(cyclobutylmethyl)piperazin-1-yl)-3-nitropyridin-2-amine
Reaction equation
[Br:12][c:13]1[c:14]([Cl:23])[c:15]([N+:20](=[O:21])[O-:22])[c:16]([NH2:19])[n:17][cH:18]1.[CH:1]1([CH2:5][N:6]2[CH2:7][CH2:8][NH:9][CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4]1.[CH:24]([OH:25])([CH3:26])[CH3:27].[CH:28]([N:29]([CH2:30][CH3:31])[CH:32]([CH3:33])[CH3:34])([CH3:35])[CH3:36]>>[CH:1]1([CH2:5][N:6]2[CH2:7][CH2:8][N:9]([c:14]3[c:13]([Br:12])[cH:18][n:17][c:16]([NH2:19])[c:15]3[N+:20](=[O:21])[O-:22])[CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4]1Participants
5
Sources & evidence
- ORD record
- ord-befc94f050a74837a0729c0eefd13381
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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