Sodium ion → 4-(5-(Ethylsulfonyl)-2-(5-fluoro-6-methoxypyridin-3-ylamino)pyridin-3-yl)-6-methyl-1,3,5-triazin-2-amine
Reaction equation
[CH2:1]([CH3:2])[S:3](=[O:4])(=[O:5])[c:6]1[cH:7][c:8](-[c:22]2[n:23][c:24]([N:29]([CH2:30][c:31]3[cH:32][cH:33][c:34]([O:35][CH3:36])[cH:37][cH:38]3)[CH2:39][c:40]3[cH:41][cH:42][c:43]([O:44][CH3:45])[cH:46][cH:47]3)[n:25][c:26]([CH3:28])[n:27]2)[c:9]([NH:12][c:13]2[cH:14][n:15][c:16]([O:20][CH3:21])[c:17]([F:19])[cH:18]2)[n:10][cH:11]1.[F:58][C:59]([F:60])([F:61])[C:62]([OH:63])=[O:64].[Na+:57].[OH-:56].[OH:48][S:49]([C:50]([F:51])([F:52])[F:53])(=[O:54])=[O:55]>>[CH2:1]([CH3:2])[S:3](=[O:4])(=[O:5])[c:6]1[cH:7][c:8](-[c:22]2[n:23][c:24]([NH2:29])[n:25][c:26]([CH3:28])[n:27]2)[c:9]([NH:12][c:13]2[cH:14][n:15][c:16]([O:20][CH3:21])[c:17]([F:19])[cH:18]2)[n:10][cH:11]1Participants
6
Sources & evidence
- ORD record
- ord-55435cf2c7c148edb58f19284a0568d9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…