5-oxidanyl-1-phenethyl-4-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-2H-pyrrol-3-one

Systemtic Name: 5-oxidanyl-1-phenethyl-4-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-2H-pyrrol-3-one Openeye Name: 5-hydroxy-1-phenethyl-4-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-2H-pyrrol-3-one CAS Name: 5-hydroxy-1-phenethyl-4-[[3-(trifluoromethyl)phenyl]methylthio]-2H-pyrrol-3-one IUPAC Name: 5-hydroxy-1-phenethyl-4-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-2H-pyrrol-3-one Traditional Name: 5-hydroxy-1-phenethyl-4-[[3-(trifluoromethyl)benzyl]thio]-2-pyrrolin-3-one Formula: C20H18F3NO2S MolecularWeight: 393.42263

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1CCC2=CC=CC=C2)O)SCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1C(=O)C(=C(N1CCC2=CC=CC=C2)O)SCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H18F3NO2S/c21-20(22,23)16-8-4-7-15(11-16)13-27-18-17(25)12-24(19(18)26)10-9-14-5-2-1-3-6-14/h1-8,11,26H,9-10,12-13H2