Acetonitrile → HCID 178464179, compound
Reaction equation
[CH2:1]([CH3:2])[N:3]([C:4](=[O:5])[c:6]1[cH:7][cH:8][c:9]2[c:10]([CH2:15][CH:16]([CH3:17])[NH2:18])[cH:11][nH:12][c:13]2[cH:14]1)[CH2:19][CH3:20].[CH2:21]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)[O:28][c:29]1[c:30]([NH:46][S:47](=[O:48])(=[O:49])[CH3:50])[cH:31][c:32]([CH:35]([CH2:36][I:37])[O:38][Si:39]([CH2:40][CH3:41])([CH2:42][CH3:43])[CH2:44][CH3:45])[cH:33][cH:34]1.[CH3:51][C:52]#[N:53]>>[CH2:1]([CH3:2])[N:3]([C:4](=[O:5])[c:6]1[cH:7][cH:8][c:9]2[c:10]([CH2:15][CH:16]([CH3:17])[NH:18][CH2:36][CH:35]([c:32]3[cH:31][c:30]([NH:46][S:47](=[O:48])(=[O:49])[CH3:50])[c:29]([O:28][CH2:21][c:22]4[cH:23][cH:24][cH:25][cH:26][cH:27]4)[cH:34][cH:33]3)[O:38][Si:39]([CH2:40][CH3:41])([CH2:42][CH3:43])[CH2:44][CH3:45])[cH:11][nH:12][c:13]2[cH:14]1)[CH2:19][CH3:20]Participants
4
Sources & evidence
- ORD record
- ord-a1b98d43496f466582c3c2011d321387
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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