Toluene → 4'-[(6-ethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl)methyl]-3'-fluorobiphenyl-2-carbonitrile
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][c:5]([O:35][CH3:36])[cH:37][cH:38][c:39]1[CH2:40][n:6]1[c:7](=[O:34])[n:8]([CH2:18][c:19]2[c:20]([F:33])[cH:21][c:22](-[c:25]3[c:26]([C:31]#[N:32])[cH:27][cH:28][cH:29][cH:30]3)[cH:23][cH:24]2)[c:9]2[c:10]([c:11]1=[O:12])[cH:13][c:14]([CH2:16][CH3:17])[s:15]2.[CH3:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[OH:41][C:42]([C:43]([F:44])([F:45])[F:46])=[O:47]>>[nH:6]1[c:7](=[O:34])[n:8]([CH2:18][c:19]2[c:20]([F:33])[cH:21][c:22](-[c:25]3[c:26]([C:31]#[N:32])[cH:27][cH:28][cH:29][cH:30]3)[cH:23][cH:24]2)[c:9]2[c:10]([c:11]1=[O:12])[cH:13][c:14]([CH2:16][CH3:17])[s:15]2Participants
4
Reactant 3
Product 1
Sources & evidence
- ORD record
- ord-2e3b42f8e61346058281b5613d5e74fd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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