Acetonitrile → HCID 178450739, compound
Reaction equation
[CH2:29]([c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1)[O:36][C:37](=[O:38])[c:39]1[cH:40][c:41]([NH:45][C:46]([NH:47][CH2:48][C:49](=[O:50])[OH:51])=[O:52])[cH:42][cH:43][cH:44]1.[CH3:68][C:69]#[N:70].[CH:53]1([N:54]=[C:55]=[N:56][CH:57]2[CH2:58][CH2:59][CH2:60][CH2:61][CH2:62]2)[CH2:63][CH2:64][CH2:65][CH2:66][CH2:67]1.[c:1]1([CH:7]2[CH:8]([C:19](=[O:20])[O:21][CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[CH2:9][CH:10]([C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[NH:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]2[CH:8]([C:19](=[O:20])[O:21][CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[CH2:9][CH:10]([C:12](=[O:13])[O:14][C:15]([CH3:16])([CH3:17])[CH3:18])[N:11]2[C:49]([CH2:48][NH:47][C:46]([NH:45][c:41]2[cH:40][c:39]([C:37]([O:36][CH2:29][c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)=[O:38])[cH:44][cH:43][cH:42]2)=[O:52])=[O:50])[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
5
Sources & evidence
- ORD record
- ord-b408b948eada4961b126a81b669b73fd
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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