Water → 2-Trifluoromethyl-4-(3-cyanophenyl)-4, 6,7,8-tetrahydro-5(1H)-quinolone
Reaction equation
[C:1]([OH:3])([CH:4]1[C:5]([OH:2])([C:24]([F:25])([F:26])[F:27])[NH:6][C:7]2=[C:12]([C:11](=[O:22])[CH2:10][CH2:9][CH2:8]2)[CH:13]1[c:14]1[cH:15][c:16]([C:20]#[N:21])[cH:17][cH:18][cH:19]1)=[O:23].[CH3:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[OH2:28].[c:29]1([CH3:30])[cH:31][cH:32][c:33]([S:34]([OH:35])(=[O:36])=[O:37])[cH:38][cH:39]1>>[CH:4]1=[C:5]([C:24]([F:25])([F:26])[F:27])[NH:6][C:7]2=[C:12]([C:11](=[O:22])[CH2:10][CH2:9][CH2:8]2)[CH:13]1[c:14]1[cH:15][c:16]([C:20]#[N:21])[cH:17][cH:18][cH:19]1Participants
5
Sources & evidence
- ORD record
- ord-2c2686faa8b349b4a577805225c288aa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
Loading…