Acetonitrile → HCID 54308876, compound
Reaction equation
[C:45]([O:46][CH2:47][CH3:48])(=[O:49])[CH3:50].[CH3:39][C:40]#[N:41].[CH:1]([CH3:2])([CH3:3])[N:4]1[C:5](=[O:17])[NH:6][CH2:7][c:8]2[c:9]1[n:10][c:11]([S:14]([CH3:15])=[O:16])[n:12][cH:13]2.[Cl:42][CH2:43][Cl:44].[NH2:18][c:19]1[cH:20][cH:21][c:22]([N:25]2[CH2:26][CH2:27][N:28]([CH3:31])[CH2:29][CH2:30]2)[cH:23][cH:24]1.[OH:32][C:33]([C:34]([F:35])([F:36])[F:37])=[O:38]>>[CH:1]([CH3:2])([CH3:3])[N:4]1[C:5](=[O:17])[NH:6][CH2:7][c:8]2[c:9]1[n:10][c:11]([NH:18][c:19]1[cH:20][cH:21][c:22]([N:25]3[CH2:26][CH2:27][N:28]([CH3:31])[CH2:29][CH2:30]3)[cH:23][cH:24]1)[n:12][cH:13]2Participants
7
Sources & evidence
- ORD record
- ord-b89318a189e44a79a5593a40b6b9de09
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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