Acrylonitrile → 3-{[6-(2,4-Difluorophenyl)-2-naphthyl]thio}propanenitrile
Reaction equation
[Br:20][c:21]1[cH:22][c:23]2[c:24]([cH:25][cH:26]1)[cH:27][c:28]([OH:29])[cH:30][cH:31]2.[CH2:32]=[CH:33][C:34]#[N:35].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[F:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[cH:12][cH:13][c:14]([SH:19])[cH:15][c:16]3[cH:17][cH:18]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1.[O:43]1[CH2:44][CH2:45][CH2:46][CH2:47]1>>[F:1][c:2]1[c:3](-[c:9]2[cH:10][c:11]3[cH:12][cH:13][c:14]([S:19][CH2:32][CH2:33][C:34]#[N:35])[cH:15][c:16]3[cH:17][cH:18]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1Participants
6
Sources & evidence
- ORD record
- ord-3f934fcefcad4b8fac3b973e6682fd41
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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