Bromide ion → 4-[4'-[(Difluoromethyl)thio][1,1'-biphenyl]-4-yl]-2-(2,6-difluorophenyl)-4,5-dihydrooxazole
Reaction equation
[Br-:41].[CH3:3][c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1.[CH3:42][CH2:43][CH2:44][CH2:45][N+:46]([CH2:47][CH2:48][CH2:49][CH3:50])([CH2:51][CH2:52][CH2:53][CH3:54])[CH2:55][CH2:56][CH2:57][CH3:58].[CH3:59][CH2:60][O:61][CH2:62][CH3:63].[Cl:10][CH2:11][CH:12]([c:13]1[cH:14][cH:15][c:16](-[c:19]2[cH:20][cH:21][c:22]([S:25][CH:26]([F:27])[F:28])[cH:23][cH:24]2)[cH:17][cH:18]1)[NH:29][C:30]([c:31]1[c:32]([F:38])[cH:33][cH:34][cH:35][c:36]1[F:37])=[O:39].[Na+:2].[OH-:1].[OH2:40]>>[CH2:11]1[CH:12]([c:13]2[cH:14][cH:15][c:16](-[c:19]3[cH:20][cH:21][c:22]([S:25][CH:26]([F:27])[F:28])[cH:23][cH:24]3)[cH:17][cH:18]2)[N:29]=[C:30]([c:31]2[c:32]([F:38])[cH:33][cH:34][cH:35][c:36]2[F:37])[O:39]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-7edeba6903804a6e818cc49aa2db4e34
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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