Acetonitrile → HCID 54076201, compound
Reaction equation
[CH3:1][O:2][C:3]([CH:4]([CH2:5][C:6](=[O:7])[OH:8])[CH2:9][c:10]1[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]1)=[O:18].[CH3:41][C:42]#[N:43].[OH:19][n:20]1[c:21]2[c:22]([cH:23][cH:24][cH:25][cH:26]2)[n:27][n:28]1.[n:29]1[cH:30][cH:31][c:32]([N:35]2[CH2:36][CH2:37][NH:38][CH2:39][CH2:40]2)[cH:33][cH:34]1>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][C:6](=[O:8])[N:38]1[CH2:37][CH2:36][N:35]([c:32]2[cH:31][cH:30][n:29][cH:34][cH:33]2)[CH2:40][CH2:39]1)[CH2:9][c:10]1[cH:11][cH:12][c:13]([O:16][CH3:17])[cH:14][cH:15]1)=[O:18]Participants
5
Sources & evidence
- ORD record
- ord-80028f82e4b44918a9de3c60c5f619e6
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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