Formic Acid → 3-{[3-Chloro-4-(methylsulfonyl)-phenyl]methylene}-2,4-pentanedione
Reaction equation
[CH2:14]1[CH2:15][CH2:16][NH:17][CH2:18][CH2:19]1.[CH3:23][C:24]([CH2:25][C:26]([CH3:27])=[O:28])=[O:29].[CH:20]([OH:21])=[O:22].[Cl:1][c:2]1[cH:3][c:4]([CH:5]=[O:6])[cH:7][cH:8][c:9]1[S:10](=[O:11])(=[O:12])[CH3:13].[O:30]=[CH:31][N:32]([CH3:33])[CH3:34].[OH2:35]>>[Cl:1][c:2]1[cH:3][c:4]([CH:5]=[C:25]([C:24]([CH3:23])=[O:29])[C:26]([CH3:27])=[O:28])[cH:7][cH:8][c:9]1[S:10](=[O:11])(=[O:12])[CH3:13]Participants
7
Sources & evidence
- ORD record
- ord-e1d32aaac6d34dd9a1fa55eeaed5d965
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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