Acetone → HCID 69064023, compound
Reaction equation
[CH3:32][C:33](=[O:34])[CH3:35].[F:5][c:6]1[cH:7][cH:8][c:9]([CH2:10][N:11]2[C:12](=[O:28])[c:13]3[c:14]([O:26][CH3:27])[c:15](=[O:25])[n:16]([CH3:24])[c:17]([C:21]([Cl:22])=[O:23])[c:18]3[CH2:19][CH2:20]2)[cH:29][cH:30]1.[N-:2]=[N+:3]=[N-:4].[Na+:1].[OH2:31]>>[NH2:2][c:17]1[n:16]([CH3:24])[c:15](=[O:25])[c:14]([O:26][CH3:27])[c:13]2[c:18]1[CH2:19][CH2:20][N:11]([CH2:10][c:9]1[cH:8][cH:7][c:6]([F:5])[cH:30][cH:29]1)[C:12]2=[O:28]Participants
6
Sources & evidence
- ORD record
- ord-0def5f53e48549cc9007eb0aab85d380
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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