Acetic Acid → 1-{5-[3-Butyl-6-(1-methyl-piperidin-4-yloxy)-pyridazin-4-yl]-2-cyclohexyloxy-phenyl}-ethanone
Reaction equation
[C:38]([O:39][BH-:40]([O:41][C:42](=[O:43])[CH3:44])[O:45][C:46](=[O:47])[CH3:48])(=[O:49])[CH3:50].[CH2:36]=[O:37].[CH2:3]([CH2:4][CH2:5][CH3:6])[c:7]1[n:8][n:9][c:10]([O:29][CH:30]2[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]2)[cH:11][c:12]1-[c:13]1[cH:14][cH:15][c:16]([O:22][CH:23]2[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]2)[c:17]([C:19]([CH3:20])=[O:21])[cH:18]1.[CH3:65][C:66](=[O:67])[OH:68].[Cl:57][CH2:58][Cl:59].[Cl:62][CH2:63][Cl:64].[ClH:1].[ClH:2].[Na+:51].[Na+:56].[O-:52][C:53]([OH:54])=[O:55].[OH2:60].[OH2:61]>>[CH2:3]([CH2:4][CH2:5][CH3:6])[c:7]1[n:8][n:9][c:10]([O:29][CH:30]2[CH2:31][CH2:32][N:33]([CH3:38])[CH2:34][CH2:35]2)[cH:11][c:12]1-[c:13]1[cH:14][cH:15][c:16]([O:22][CH:23]2[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]2)[c:17]([C:19]([CH3:20])=[O:21])[cH:18]1Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-ecbe043ae05648048b9d949912f9f325
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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