Acetonitrile → 4-(3-Benzyloxycarbonylaminomethyl-phenyl)-1-(5-phenethyl-pyridine-3-carbonyl)-piperidine-4-carbonitrile
Reaction equation
[B-:27]([F:28])([F:29])([F:30])[F:31].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH2:12][c:13]1[cH:14][c:15]([C:19]2([C:25]#[N:26])[CH2:20][CH2:21][NH:22][CH2:23][CH2:24]2)[cH:16][cH:17][cH:18]1.[CH2:49]([CH2:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1)[c:57]1[cH:58][c:59]([C:63](=[O:64])[OH:65])[cH:60][n:61][cH:62]1.[CH3:66][C:67]#[N:68].[n:32]1([O:33][C:34]([N:35]([CH3:36])[CH3:37])=[N+:38]([CH3:39])[CH3:40])[c:41]2[cH:42][cH:43][cH:44][cH:45][c:46]2[n:47][n:48]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH2:12][c:13]1[cH:14][c:15]([C:19]2([C:25]#[N:26])[CH2:20][CH2:21][N:22]([C:63]([c:59]3[cH:58][c:57]([CH2:49][CH2:50][c:51]4[cH:52][cH:53][cH:54][cH:55][cH:56]4)[cH:62][n:61][cH:60]3)=[O:64])[CH2:23][CH2:24]2)[cH:16][cH:17][cH:18]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-1ca4150d4c174ed9a47fd0d1853a23a8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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