Ethanol → 3-Fluoro-10-[4-(3-hydroxypropyl)piperazino]-8-isopropyl-10,11-dihydrodibenzo (b,f) thiepin
Reaction equation
[CH3:35][CH2:36][OH:37].[CH:31]([Cl:32])([Cl:33])[Cl:34].[Cl:1][CH:2]1[CH2:3][c:4]2[c:5]([cH:16][c:17]([F:20])[cH:18][cH:19]2)[S:6][c:7]2[c:8]1[cH:9][c:10]([CH:13]([CH3:14])[CH3:15])[cH:11][cH:12]2.[OH:21][CH2:22][CH2:23][CH2:24][N:25]1[CH2:26][CH2:27][NH:28][CH2:29][CH2:30]1>>[CH:2]1([N:28]2[CH2:27][CH2:26][N:25]([CH2:24][CH2:23][CH2:22][OH:21])[CH2:30][CH2:29]2)[CH2:3][c:4]2[c:5]([cH:16][c:17]([F:20])[cH:18][cH:19]2)[S:6][c:7]2[c:8]1[cH:9][c:10]([CH:13]([CH3:14])[CH3:15])[cH:11][cH:12]2Participants
5
Sources & evidence
- ORD record
- ord-bdce79688f314805b9df1619405916a1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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