1-(3-Ethyl-2,4-dihydroxyphenyl)ethanone → 5-(4-((4-Acetyl-2-ethyl-3-hydroxyphenoxy)methyl)phenylthio)nicotinonitrile
Reaction equation
[CH2:18]([CH3:19])[c:20]1[c:21]([OH:30])[c:22]([C:27]([CH3:28])=[O:29])[cH:23][cH:24][c:25]1[OH:26].[OH:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([S:9][c:10]2[cH:11][n:12][cH:13][c:14]([C:15]#[N:16])[cH:17]2)[cH:7][cH:8]1>>[O:1]([CH2:2][c:3]1[cH:4][cH:5][c:6]([S:9][c:10]2[cH:11][n:12][cH:13][c:14]([C:15]#[N:16])[cH:17]2)[cH:7][cH:8]1)[c:25]1[c:20]([CH2:18][CH3:19])[c:21]([OH:30])[c:22]([C:27]([CH3:28])=[O:29])[cH:23][cH:24]1Participants
3
Sources & evidence
- ORD record
- ord-976d05facb35422eab6bb3bcd7bab42e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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