Chloride → N-[[3-ethynyl-5-fluoro-4-(methanesulfonamido)phenyl]methyl]-3-[2-propylsulfanyl-6-(trifluoromethyl)pyridin-3-yl]prop-2-enamide
Reaction equation
[CH2:37]([CH2:38][CH3:39])[S:40][c:41]1[n:42][c:43]([C:52]([F:53])([F:54])[F:55])[cH:44][cH:45][c:46]1[CH:47]=[CH:48][C:49](=[O:50])[OH:51].[CH3:20][O:21][c:22]1[n:23][c:24]([O:25][CH3:26])[n:27][c:28]([N+:29]2([CH3:30])[CH2:31][CH2:32][O:33][CH2:34][CH2:35]2)[n:36]1.[Cl-:19].[ClH:17].[NH2:1][CH2:2][c:3]1[cH:4][c:5]([F:16])[c:6]([NH:11][S:12](=[O:13])(=[O:14])[CH3:15])[c:7]([C:9]#[CH:10])[cH:8]1.[OH2:18]>>[NH:1]([CH2:2][c:3]1[cH:4][c:5]([F:16])[c:6]([NH:11][S:12](=[O:13])(=[O:14])[CH3:15])[c:7]([C:9]#[CH:10])[cH:8]1)[C:49]([CH:48]=[CH:47][c:46]1[c:41]([S:40][CH2:37][CH2:38][CH3:39])[n:42][c:43]([C:52]([F:53])([F:54])[F:55])[cH:44][cH:45]1)=[O:50]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-0d0d991aafe64fd89536c45e2c053a4b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…