Water → 5-Methyl-1-[4-(4-trifluoromethylbenzoyl)benzyl]-1H-pyrrolo [2,3-d]pyridazin-4(5H)-one
Reaction equation
[CH3:1][n:2]1[n:3][cH:4][c:5]2[c:6]([c:7]1=[O:8])[cH:9][cH:10][nH:11]2.[F:12][C:13]([c:14]1[cH:15][cH:16][c:17]([C:18](=[O:19])[c:20]2[cH:21][cH:22][c:23]([CH2:24][Br:25])[cH:26][cH:27]2)[cH:28][cH:29]1)([F:30])[F:31].[O:33]=[CH:34][N:35]([CH3:36])[CH3:37].[OH2:32]>>[CH3:1][n:2]1[n:3][cH:4][c:5]2[c:6]([c:7]1=[O:8])[cH:9][cH:10][n:11]2[CH2:24][c:23]1[cH:22][cH:21][c:20]([C:18]([c:17]2[cH:16][cH:15][c:14]([C:13]([F:12])([F:30])[F:31])[cH:29][cH:28]2)=[O:19])[cH:27][cH:26]1Participants
5
Sources & evidence
- ORD record
- ord-992f4f85e8864168ba6f91dbf83a4810
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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