Acetone → HCID 72393487, compound
Reaction equation
[CH3:39][C:40]([CH3:41])=[O:42].[NH:1]1[CH:2]([CH:6]([CH3:7])[NH:8][c:9]2[n:10][c:11]([C:35]([F:36])([F:37])[F:38])[cH:12][cH:13][c:14]2-[c:15]2[cH:16][c:17]([O:21][c:22]3[cH:23][cH:24][cH:25][c:26]4[c:27]3[n:28][c:29]([NH:31][C:32]([CH3:33])=[O:34])[s:30]4)[n:18][cH:19][n:20]2)[CH2:3][CH2:4][CH2:5]1>>[N:1]1([CH:40]([CH3:39])[CH3:41])[CH:2]([CH:6]([CH3:7])[NH:8][c:9]2[n:10][c:11]([C:35]([F:36])([F:37])[F:38])[cH:12][cH:13][c:14]2-[c:15]2[cH:16][c:17]([O:21][c:22]3[cH:23][cH:24][cH:25][c:26]4[c:27]3[n:28][c:29]([NH:31][C:32]([CH3:33])=[O:34])[s:30]4)[n:18][cH:19][n:20]2)[CH2:3][CH2:4][CH2:5]1Participants
3
Sources & evidence
- ORD record
- ord-56992ad3328b41f7b67ff41032b2bb35
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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