Ammonia → 5-[({[3'-(aminomethyl)biphenyl-4-yl]methyl}sulfonyl)methyl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Reaction equation
[CH2:27]1[O:28][CH2:29][CH2:30][CH2:31]1.[NH3:26].[O:1]=[c:2]1[nH:3][c:4]([CH2:7][S:8](=[O:9])(=[O:10])[CH2:11][c:12]2[cH:13][cH:14][c:15](-[c:18]3[cH:19][c:20]([C:24]#[N:25])[cH:21][cH:22][cH:23]3)[cH:16][cH:17]2)[n:5][nH:6]1>>[O:1]=[c:2]1[nH:3][c:4]([CH2:7][S:8](=[O:9])(=[O:10])[CH2:11][c:12]2[cH:13][cH:14][c:15](-[c:18]3[cH:19][c:20]([CH2:24][NH2:25])[cH:21][cH:22][cH:23]3)[cH:16][cH:17]2)[n:5][nH:6]1Participants
4
Sources & evidence
- ORD record
- ord-4430c3dd981a4ee69af80dbe4afadce8
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…