Acetone → HCID 23634345, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:11][C:12](=[O:13])[NH:14][c:15]2[c:16]([F:30])[cH:17][c:18]([O:21][c:22]3[cH:23][c:24]([C:28]#[N:29])[n:25][cH:26][cH:27]3)[cH:19][cH:20]2)[n:8][cH:9][n:10]1.[CH3:32][C:33](=[O:34])[CH3:35].[OH2:31]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([NH:11][C:12](=[O:13])[NH:14][c:15]2[c:16]([F:30])[cH:17][c:18]([O:21][c:22]3[cH:23][c:24]([C:28]([NH2:29])=[O:34])[n:25][cH:26][cH:27]3)[cH:19][cH:20]2)[n:8][cH:9][n:10]1Participants
4
Sources & evidence
- ORD record
- ord-cd790b35ddc940cd97f1b1fb7bf069b6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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