Acetonitrile → HCID 22050601, compound
Reaction equation
[Br:30][NH:31][C:32](=[O:33])[CH2:34][CH2:35][C:36]([NH2:37])=[O:38].[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6](-[n:11]2[c:12](=[O:28])[cH:13][c:14]([O:18][CH2:19][c:20]3[c:21]([F:27])[cH:22][c:23]([F:26])[cH:24][cH:25]3)[cH:15][c:16]2[CH3:17])[c:7]([Cl:10])[cH:8][cH:9]1)=[O:29].[CH3:39][C:40]#[N:41]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6](-[n:11]2[c:12](=[O:28])[c:13]([Br:30])[c:14]([O:18][CH2:19][c:20]3[c:21]([F:27])[cH:22][c:23]([F:26])[cH:24][cH:25]3)[cH:15][c:16]2[CH3:17])[c:7]([Cl:10])[cH:8][cH:9]1)=[O:29]Participants
4
Sources & evidence
- ORD record
- ord-dad0d5cba26f4dfd92f2de3ffc5e666d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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