5-Methylsulfonyl-2-(2,2,2-trifluoro-1-methylethoxy)benzoic acid → [5-Iodo-6-(trifluoromethyl)-1,3-dihydroisoindol-2-yl]-[5-methylsulfonyl-2-(1,1,1-trifluoropropan-2-yloxy)phenyl]methanone
Reaction equation
[CH3:15][S:16](=[O:17])(=[O:18])[c:19]1[cH:20][cH:21][c:22]([O:28][CH:29]([C:30]([F:31])([F:32])[F:33])[CH3:34])[c:23]([C:24](=[O:25])[OH:26])[cH:27]1.[I:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][c:10]1[C:11]([F:12])([F:13])[F:14])[CH2:7][NH:6][CH2:5]2>>[I:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][c:10]1[C:11]([F:12])([F:13])[F:14])[CH2:7][N:6]([C:24]([c:23]1[c:22]([O:28][CH:29]([C:30]([F:31])([F:32])[F:33])[CH3:34])[cH:21][cH:20][c:19]([S:16]([CH3:15])(=[O:17])=[O:18])[cH:27]1)=[O:25])[CH2:5]2Participants
3
Sources & evidence
- ORD record
- ord-df572e34fa8b41929d0eea67f528e6ae
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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