1-(4-Methoxy-3-methylphenyl)-4-phenethylpiperazine → 2-[4-(3-Cyclohexylpropyl)piperazin-1-yl]-5-hydroxybenzonitrile
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([N:7]2[CH2:8][CH2:9][N:10]([CH2:11][CH2:12][c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[CH2:19][CH2:20]2)[cH:21][c:22]1[CH3:23].[CH:24]1([CH2:30][CH2:31][CH2:32][N:33]2[CH2:34][CH2:35][N:36]([c:39]3[c:40]([C:41]#[N:42])[cH:43][c:44]([O:47][CH3:48])[cH:45][cH:46]3)[CH2:37][CH2:38]2)[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]1>>[CH:24]1([CH2:30][CH2:31][CH2:32][N:33]2[CH2:34][CH2:35][N:36]([c:39]3[c:40]([C:41]#[N:42])[cH:43][c:44]([OH:47])[cH:45][cH:46]3)[CH2:37][CH2:38]2)[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]1Participants
3
Sources & evidence
- ORD record
- ord-7425757b8b3b400492d376beca5ad13d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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