1-Methylpiperazine → [1-Isopropoxy-3-(5-methyl-1H-pyrazol-3-ylamino)-isoquinolin-6-yl]-(4-methyl-piperazin-1-yl)-methanone
Reaction equation
[CH3:25][N:26]1[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]1.[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[n:6][c:7]([NH:18][c:19]2[n:20][nH:21][c:22]([CH3:24])[cH:23]2)[cH:8][c:9]2[cH:10][c:11]([C:15](=[O:16])[OH:17])[cH:12][cH:13][c:14]12>>[CH:1]([CH3:2])([CH3:3])[O:4][c:5]1[n:6][c:7]([NH:18][c:19]2[n:20][nH:21][c:22]([CH3:24])[cH:23]2)[cH:8][c:9]2[cH:10][c:11]([C:15](=[O:16])[N:29]3[CH2:28][CH2:27][N:26]([CH3:25])[CH2:31][CH2:30]3)[cH:12][cH:13][c:14]12Participants
3
Sources & evidence
- ORD record
- ord-e777c473fe04436aa0ac7580cb8f8e0c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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