Acetonitrile → HCID 178486849, compound
Reaction equation
[C:22](=[O:23])([O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[NH:29][CH:30]([CH:31]([CH3:32])[CH3:33])[C:34](=[O:35])[OH:36].[CH3:52][C:53]#[N:54].[CH:37]1([N:38]=[C:39]=[N:40][CH:41]2[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]2)[CH2:47][CH2:48][CH2:49][CH2:50][CH2:51]1.[NH2:1][CH:2]1[CH2:3][CH2:4][N:5]([c:8]2[n:9][cH:10][n:11][c:12]3[cH:13][c:14]([O:20][CH3:21])[c:15]([O:18][CH3:19])[cH:16][c:17]23)[CH2:6][CH2:7]1>>[NH:1]([CH:2]1[CH2:3][CH2:4][N:5]([c:8]2[n:9][cH:10][n:11][c:12]3[cH:13][c:14]([O:20][CH3:21])[c:15]([O:18][CH3:19])[cH:16][c:17]23)[CH2:6][CH2:7]1)[C:34]([CH:30]([NH:29][C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH:31]([CH3:32])[CH3:33])=[O:35]Participants
5
Sources & evidence
- ORD record
- ord-2922cac7c1604ea68d3f62327ce37646
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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