Acetonitrile → HCID 178471617, compound
Reaction equation
[CH2:37]([CH3:38])[O:39][C:40]([CH:41]=[C:42]([CH2:43][Br:44])[O:45][c:46]1[c:47]([Cl:52])[cH:48][cH:49][cH:50][cH:51]1)=[O:53].[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH2:6][O:7][CH3:8])[NH:9][C:10]([O:11][CH2:12][CH:13]1[c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]2-[c:20]2[c:21]1[cH:22][cH:23][cH:24][cH:25]2)=[O:26])=[O:27].[CH3:54][C:55]#[N:56].[CH:28]([N:29]([CH2:30][CH3:31])[CH:32]([CH3:33])[CH3:34])([CH3:35])[CH3:36]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][CH2:6][O:7][CH3:8])[NH:9][CH2:43][C:42](=[CH:41][C:40]([O:39][CH2:37][CH3:38])=[O:53])[O:45][c:46]1[c:47]([Cl:52])[cH:48][cH:49][cH:50][cH:51]1)=[O:27]Participants
5
Sources & evidence
- ORD record
- ord-3f9a0f60abef45da8785b6353d9a46cf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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