N-[4-[[5-[2,4-bis(fluoranyl)phenyl]carbonyl-1-methyl-pyrrol-2-yl]methyl]-3-fluoranyl-phenyl]-2-oxidanyl-ethanesulfonamide

Systemtic Name: N-[4-[[5-[2,4-bis(fluoranyl)phenyl]carbonyl-1-methyl-pyrrol-2-yl]methyl]-3-fluoranyl-phenyl]-2-oxidanyl-ethanesulfonamide Openeye Name: N-[4-[[5-(2,4-difluorobenzoyl)-1-methyl-pyrrol-2-yl]methyl]-3-fluoro-phenyl]-2-hydroxy-ethanesulfonamide CAS Name: N-[4-[[5-[(2,4-difluorophenyl)-oxomethyl]-1-methyl-2-pyrrolyl]methyl]-3-fluorophenyl]-2-hydroxyethanesulfonamide IUPAC Name: N-[4-[[5-(2,4-difluorobenzoyl)-1-methylpyrrol-2-yl]methyl]-3-fluorophenyl]-2-hydroxyethanesulfonamide Traditional Name: N-[4-[[5-(2,4-difluorobenzoyl)-1-methyl-pyrrol-2-yl]methyl]-3-fluoro-phenyl]-2-hydroxy-ethanesulfonamide Formula: C21H19F3N2O4S MolecularWeight: 452.44677

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(=O)C2=C(C=C(C=C2)F)F)CC3=C(C=C(C=C3)NS(=O)(=O)CCO)F

Isomeric SMILES

CN1C(=CC=C1C(=O)C2=C(C=C(C=C2)F)F)CC3=C(C=C(C=C3)NS(=O)(=O)CCO)F

InChI

InChI=1S/C21H19F3N2O4S/c1-26-16(5-7-20(26)21(28)17-6-3-14(22)11-19(17)24)10-13-2-4-15(12-18(13)23)25-31(29,30)9-8-27/h2-7,11-12,25,27H,8-10H2,1H3