6-Piperazin-1-yl-pyridazin-3-carboxylic acid (3-methylbutyl)amide → HCID 86597218, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][n:10][c:11]([C:17](=[O:18])[OH:19])[c:12]1[C:13]([F:14])([F:15])[F:16].[CH3:20][CH:21]([CH2:22][CH2:23][NH:24][C:25](=[O:26])[c:27]1[n:28][n:29][c:30]([N:33]2[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]2)[cH:31][cH:32]1)[CH3:39]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[n:9][n:10][c:11]([C:17](=[O:19])[N:36]2[CH2:35][CH2:34][N:33]([c:30]3[n:29][n:28][c:27]([C:25]([NH:24][CH2:23][CH2:22][CH:21]([CH3:20])[CH3:39])=[O:26])[cH:32][cH:31]3)[CH2:38][CH2:37]2)[c:12]1[C:13]([F:14])([F:15])[F:16]Participants
3
Sources & evidence
- ORD record
- ord-4ae60efa36d84667b5e2cfba0c3fbff0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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