Water → 1-[4-(4-Methoxybenzoyl)benzyl]-2,3,5-trimethyl-1H-pyrrolo [2,3-d]pyridazin-4(5H)-one
Reaction equation
[CH3:14][O:15][c:16]1[cH:17][cH:18][c:19]([C:20](=[O:21])[c:22]2[cH:23][cH:24][c:25]([CH2:26][Br:27])[cH:28][cH:29]2)[cH:30][cH:31]1.[CH3:1][c:2]1[c:3]([CH3:13])[c:4]2[c:5]([cH:6][n:7][n:8]([CH3:11])[c:9]2=[O:10])[nH:12]1.[O:33]=[CH:34][N:35]([CH3:36])[CH3:37].[OH2:32]>>[CH3:1][c:2]1[c:3]([CH3:13])[c:4]2[c:5]([cH:6][n:7][n:8]([CH3:11])[c:9]2=[O:10])[n:12]1[CH2:26][c:25]1[cH:24][cH:23][c:22]([C:20]([c:19]2[cH:18][cH:17][c:16]([O:15][CH3:14])[cH:31][cH:30]2)=[O:21])[cH:29][cH:28]1Participants
5
Sources & evidence
- ORD record
- ord-bfdbe59377a6480a9218d365c0df902d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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