Benzene → 4-Chloro-2-(2-fluoro-6-methoxyphenyl)-7-methylquinazoline
Reaction equation
[CH3:22][N:23]([c:24]1[cH:25][cH:26][cH:27][cH:28][cH:29]1)[CH3:30].[Cl:47][CH2:48][Cl:49].[F:1][c:2]1[c:3](-[c:10]2[n:11][c:12]3[cH:13][c:14]([CH3:21])[cH:15][cH:16][c:17]3[c:18](=[O:20])[nH:19]2)[c:4]([O:8][CH3:9])[cH:5][cH:6][cH:7]1.[Na+:40].[O-:36][C:37]([OH:38])=[O:39].[P:31]([Cl:32])([Cl:33])([Cl:34])=[O:35].[cH:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1>>[F:1][c:2]1[c:3](-[c:10]2[n:11][c:12]3[cH:13][c:14]([CH3:21])[cH:15][cH:16][c:17]3[c:18]([Cl:33])[n:19]2)[c:4]([O:8][CH3:9])[cH:5][cH:6][cH:7]1Participants
8
Sources & evidence
- ORD record
- ord-cb7d5c58d3c2405ea3f206ae83193c97
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…