5-Nitrothiophene-2-carboxaldehyde → 3-(5-Nitrothiophen-2-yl)-2-[[3-(trifluoromethyl)phenyl]methylsulfonyl]prop-2-enenitrile
Reaction equation
[F:11][C:12]([c:13]1[cH:14][c:15]([CH2:16][S:17](=[O:18])(=[O:19])[CH2:20][C:21]#[N:22])[cH:23][cH:24][cH:25]1)([F:26])[F:27].[N+:1](=[O:2])([O-:3])[c:4]1[s:5][c:6]([CH:9]=[O:10])[cH:7][cH:8]1>>[N+:1](=[O:2])([O-:3])[c:4]1[s:5][c:6]([CH:9]=[C:20]([S:17]([CH2:16][c:15]2[cH:14][c:13]([C:12]([F:11])([F:26])[F:27])[cH:25][cH:24][cH:23]2)(=[O:18])=[O:19])[C:21]#[N:22])[cH:7][cH:8]1Participants
3
Sources & evidence
- ORD record
- ord-a7dfc48686e24c76bb4ec89e11b63ff5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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