Ethanol → 4-(2,5-difluorophenyl)-1-(2-methylsulfonylethyl)-2-phenyl-2,5-dihydropyrrole

HRID 101979Notes

Reaction equation

HRID 101979 reaction equation
[CH3:43][CH2:44][OH:45].[CH:37](=[CH2:38])[S:39](=[O:40])(=[O:41])[CH3:42].[Cl:27][CH2:28][Cl:29].[F:1][c:2]1[c:3]([C:9]2=[CH:10][CH:11]([c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[N:12]([C:14]([O:15][C:16]([CH3:17])([CH3:18])[CH3:19])=[O:20])[CH2:13]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1.[O:46]1[CH2:47][CH2:48][O:49][CH2:50][CH2:51]1.[OH:30][C:31]([C:32]([F:33])([F:34])[F:35])=[O:36]>>[F:1][c:2]1[c:3]([C:9]2=[CH:10][CH:11]([c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[N:12]([CH2:14][CH2:37][S:39](=[O:40])(=[O:41])[CH3:42])[CH2:13]2)[cH:4][c:5]([F:8])[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 702EthanolHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 19354Methyl vinyl sulfoneHCID 312751,4-DioxaneHCID 59001784tert-butyl 4-(2,5-difluorophenyl)-2-phenyl-2,5-dihydro-1H-pyrrole-1-carboxylate

Product 1

HCID 1785048844-(2,5-difluorophenyl)-1-(2-methylsulfonylethyl)-2-phenyl-2,5-dihydropyrrole

Sources & evidence

ORD record
ord-5acc5392c502476d8d2deaa4091747b3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

Loading…