Acetonitrile → HCID 178465459, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH3:10])[C:11](=[O:12])[OH:13].[C:21]([Cl:22])(=[O:23])[C:24]([CH3:25])([CH3:26])[CH3:27].[CH3:14][N:15]1[CH2:16][CH2:17][O:18][CH2:19][CH2:20]1.[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[CH3:52][C:53]#[N:54].[NH2:28][c:29]1[cH:30][cH:31][c:32](-[c:35]2[n:36][cH:37][c:38]([C:42](=[O:43])[OH:44])[c:39]([OH:41])[n:40]2)[cH:33][cH:34]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]([CH3:10])[C:11](=[O:13])[NH:28][c:29]1[cH:30][cH:31][c:32](-[c:35]2[n:36][cH:37][c:38]([C:42](=[O:43])[OH:44])[c:39]([OH:41])[n:40]2)[cH:33][cH:34]1Participants
7
Sources & evidence
- ORD record
- ord-07126f3899e64d26abe060a68a1634a0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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