Acetonitrile → HCID 57829251, compound
Reaction equation
[C:37](=[O:38])([O-:39])[O-:40].[CH3:43][S:44]([Cl:45])(=[O:46])=[O:47].[CH3:48][C:49]#[N:50].[Cs+:41].[Cs+:42].[NH2:1][c:2]1[cH:3][cH:4][c:5]([NH:8][c:9]2[c:10]([CH2:11][N:12]3[C:13](=[O:31])[N:14]([c:20]4[cH:21][c:22]([C:27]([F:28])([F:29])[F:30])[c:23]([F:26])[cH:24][cH:25]4)[C:15](=[O:19])[C:16]3([CH3:17])[CH3:18])[cH:32][cH:33][c:34]([F:36])[cH:35]2)[cH:6][cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([NH:8][c:9]2[c:10]([CH2:11][N:12]3[C:13](=[O:31])[N:14]([c:20]4[cH:21][c:22]([C:27]([F:28])([F:29])[F:30])[c:23]([F:26])[cH:24][cH:25]4)[C:15](=[O:19])[C:16]3([CH3:17])[CH3:18])[cH:32][cH:33][c:34]([F:36])[cH:35]2)[cH:6][cH:7]1)[S:44]([CH3:43])(=[O:46])=[O:47]Participants
6
Sources & evidence
- ORD record
- ord-213ce4fc1f654e98a9e89bc0648b9ab3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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