Acetyl chloride → HCID 59410667, compound
Reaction equation
[CH2:43]1[O:44][CH2:45][CH2:46][CH2:47]1.[CH3:39][C:40]([Cl:41])=[O:42].[CH:1]([CH3:2])([CH3:3])[NH:4][CH2:5][CH2:6][O:7][c:8]1[c:9]([C:26]([F:27])([F:28])[F:29])[cH:10][c:11](-[c:14]2[cH:15][c:16]3[c:17]([c:18]([C:20]#[N:21])[n:19]2)[n:22][cH:23][n:24]3[CH3:25])[cH:12][cH:13]1.[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38]>>[CH:1]([CH3:2])([CH3:3])[N:4]([CH2:5][CH2:6][O:7][c:8]1[c:9]([C:26]([F:27])([F:28])[F:29])[cH:10][c:11](-[c:14]2[cH:15][c:16]3[c:17]([c:18]([C:20]#[N:21])[n:19]2)[n:22][cH:23][n:24]3[CH3:25])[cH:12][cH:13]1)[C:40]([CH3:39])=[O:42]Participants
5
Sources & evidence
- ORD record
- ord-822bddb7763b460eb74d9c23930483ec
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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