Acetonitrile → HCID 53882130, compound
Reaction equation
[Br:44][CH2:45][C:46](=[O:47])[O:48][CH2:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:56][C:57]#[N:58].[Cl:1][c:2]1[cH:3][c:4]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([O:32][CH2:33][CH:34]4[CH2:35][CH2:36]4)[c:17]([NH:20][C:21]([CH:22]=[CH:23][CH2:24][N:25]4[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]4)=[O:31])[cH:18][c:19]23)[cH:5][cH:6][c:7]1[F:8]>>[Cl:1][c:2]1[cH:3][c:4]([NH:9][c:10]2[n:11][cH:12][n:13][c:14]3[cH:15][c:16]([O:32][CH2:33][CH:34]4[CH2:35][CH2:36]4)[c:17]([NH:20][C:21]([CH:22]=[CH:23][CH2:24][N:25]4[CH2:26][CH2:27][N:28]([CH2:45][C:46](=[O:47])[O:48][CH2:49][c:50]5[cH:51][cH:52][cH:53][cH:54][cH:55]5)[CH2:29][CH2:30]4)=[O:31])[cH:18][c:19]23)[cH:5][cH:6][c:7]1[F:8]Participants
5
Sources & evidence
- ORD record
- ord-2282ac8621c74574943a3b2dfa564a99
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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