Ethanol → 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-(1-methylthieno[3,2-c]pyrazol-3-yl)phenoxy]propan-2-ol
Reaction equation
[CH2:1]1[NH:2][CH2:3][CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21.[CH3:11][n:12]1[n:13][c:14](-[c:20]2[cH:21][c:22]([O:26][CH2:27][CH:28]3[O:29][CH2:30]3)[cH:23][cH:24][cH:25]2)[c:15]2[c:16]1[cH:17][cH:18][s:19]2.[CH3:31][CH2:32][OH:33]>>[CH2:1]1[N:2]([CH2:30][CH:28]([CH2:27][O:26][c:22]2[cH:21][c:20](-[c:14]3[n:13][n:12]([CH3:11])[c:16]4[c:15]3[s:19][cH:18][cH:17]4)[cH:25][cH:24][cH:23]2)[OH:29])[CH2:3][CH2:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21Participants
4
Sources & evidence
- ORD record
- ord-a0a9c466e36a476c9adc582ff9607fa5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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