Ammonium → 3-{1-[6-(2,4-Difluorophenyl)pyridin-2-yl]-2-oxobut-3-yn-1-yl}-4-fluorobenzonitrile
Reaction equation
[CH2:34]([N+:35]([CH2:36][CH2:37][CH2:38][CH3:39])([CH2:40][CH2:41][CH2:42][CH3:43])[CH2:44][CH2:45][CH2:46][CH3:47])[CH2:48][CH2:49][CH3:50].[CH2:53]1[O:54][CH2:55][CH2:56][CH2:57]1.[Cl-:51].[F-:33].[F:1][c:2]1[c:3](-[c:9]2[cH:10][cH:11][cH:12][c:13]([CH:15]([C:16]([C:17]#[C:18][Si:19]([CH3:20])([CH3:21])[CH3:22])=[O:23])[c:24]3[cH:25][c:26]([C:27]#[N:28])[cH:29][cH:30][c:31]3[F:32])[n:14]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1.[NH4+:52]>>[F:1][c:2]1[c:3](-[c:9]2[cH:10][cH:11][cH:12][c:13]([CH:15]([C:16]([C:17]#[CH:18])=[O:23])[c:24]3[cH:25][c:26]([C:27]#[N:28])[cH:29][cH:30][c:31]3[F:32])[n:14]2)[cH:4][cH:5][c:6]([F:8])[cH:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-97956fc2f7764d1c9d80aff044c2e75f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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