Methanol → N-(3-acetylphenyl)-N'-{(4aSR,8SR,8aRS)-2-[3-(4-fluorophenyl)propyl]-decahydroisoquinolin-8-yl}urea
Reaction equation
[C:22]([CH3:23])(=[O:24])[c:25]1[cH:26][c:27]([N:31]=[C:32]=[O:33])[cH:28][cH:29][cH:30]1.[CH3:34][OH:35].[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][CH2:10][N:11]2[CH2:12][CH:13]3[CH:14]([NH2:21])[CH2:15][CH2:16][CH2:17][CH:18]3[CH2:19][CH2:20]2)[cH:6][cH:7]1.[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][CH2:10][N:11]2[CH2:12][CH:13]3[CH:14]([NH:21][C:32]([NH:31][c:27]4[cH:26][c:25]([C:22]([CH3:23])=[O:24])[cH:30][cH:29][cH:28]4)=[O:33])[CH2:15][CH2:16][CH2:17][CH:18]3[CH2:19][CH2:20]2)[cH:6][cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-cd1567a34f404a1ca473fcbc47dbb967
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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