5-oxidanyl-2-phenethyl-4-[[3-(trifluoromethyloxy)phenyl]methylsulfanyl]-1,2-dihydropyrrol-3-one

Systemtic Name: 5-oxidanyl-2-phenethyl-4-[[3-(trifluoromethyloxy)phenyl]methylsulfanyl]-1,2-dihydropyrrol-3-one Openeye Name: 5-hydroxy-2-phenethyl-4-[[3-(trifluoromethoxy)phenyl]methylsulfanyl]-1,2-dihydropyrrol-3-one CAS Name: 5-hydroxy-2-phenethyl-4-[[3-(trifluoromethoxy)phenyl]methylthio]-1,2-dihydropyrrol-3-one IUPAC Name: 5-hydroxy-2-phenethyl-4-[[3-(trifluoromethoxy)phenyl]methylsulfanyl]-1,2-dihydropyrrol-3-one Traditional Name: 5-hydroxy-2-phenethyl-4-[[3-(trifluoromethoxy)benzyl]thio]-2-pyrrolin-3-one Formula: C20H18F3NO3S MolecularWeight: 409.42203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2C(=O)C(=C(N2)O)SCC3=CC(=CC=C3)OC(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCC2C(=O)C(=C(N2)O)SCC3=CC(=CC=C3)OC(F)(F)F

InChI

InChI=1S/C20H18F3NO3S/c21-20(22,23)27-15-8-4-7-14(11-15)12-28-18-17(25)16(24-19(18)26)10-9-13-5-2-1-3-6-13/h1-8,11,16,24,26H,9-10,12H2