1-[4-(2-Isobutoxyethyl)phenoxy]-2,3-epoxypropane → 6-[1-[3-[3-(4-(2-Isobutoxyethyl)phenoxy)-2hydroxypropylamino]propyl]benzimidazol-5-yl]-4,5-dihydro-3-(2H)-pyridazinone
Reaction equation
[CH2:1]([CH:2]([CH3:3])[CH3:4])[O:5][CH2:6][CH2:7][c:8]1[cH:9][cH:10][c:11]([O:12][CH2:13][CH:14]2[CH2:15][O:16]2)[cH:17][cH:18]1.[NH2:19][CH2:20][CH2:21][CH2:22][n:23]1[cH:24][n:25][c:26]2[c:27]1[cH:28][cH:29][c:30]([C:32]1=[N:37][NH:36][C:35](=[O:38])[CH2:34][CH2:33]1)[cH:31]2>>[CH2:1]([CH:2]([CH3:3])[CH3:4])[O:5][CH2:6][CH2:7][c:8]1[cH:9][cH:10][c:11]([O:12][CH2:13][CH:14]([CH2:15][NH:19][CH2:20][CH2:21][CH2:22][n:23]2[cH:24][n:25][c:26]3[c:27]2[cH:28][cH:29][c:30]([C:32]2=[N:37][NH:36][C:35](=[O:38])[CH2:34][CH2:33]2)[cH:31]3)[OH:16])[cH:17][cH:18]1Participants
3
Sources & evidence
- ORD record
- ord-0d08b42e793543c9ae6e494171e48c0f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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