Acetonitrile → HCID 178475442, compound
Reaction equation
[C:34]([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)(=[O:41])[O:42][CH2:43][CH:44]1[O:45][CH:46]([O:56][C:57](=[O:58])[CH3:59])[C:47]([CH3:54])([F:55])[C:48]1([CH3:49])[O:50][C:51]([CH3:52])=[O:53].[CH3:60][C:61]#[N:62].[Cl:1][c:2]1[c:3]2[nH:4][cH:5][n:6][c:7]2[n:8][cH:9][n:10]1.[F:22][C:23]([F:24])([F:25])[S:26]([O:27][Si:28]([CH3:29])([CH3:30])[CH3:31])(=[O:32])=[O:33].[N:11]12[CH2:12][CH2:13][CH2:14][N:15]=[C:16]1[CH2:17][CH2:18][CH2:19][CH2:20][CH2:21]2>>[Cl:1][c:2]1[c:3]2[n:4][cH:5][n:6]([CH:46]3[O:45][CH:44]([CH2:43][O:42][C:34]([c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)=[O:41])[C:48]([CH3:49])([O:50][C:51]([CH3:52])=[O:53])[C:47]3([CH3:54])[F:55])[c:7]2[n:8][cH:9][n:10]1Participants
6
Sources & evidence
- ORD record
- ord-52d135c7eced4b8e91281bcbda27ece1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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