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

Systemtic Name: 5-oxidanyl-1-(phenylmethyl)-4-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-2H-pyrrol-3-one Openeye Name: 1-benzyl-5-hydroxy-4-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-2H-pyrrol-3-one CAS Name: 5-hydroxy-1-(phenylmethyl)-4-[[3-(trifluoromethyl)phenyl]methylthio]-2H-pyrrol-3-one IUPAC Name: 1-benzyl-5-hydroxy-4-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-2H-pyrrol-3-one Traditional Name: 1-benzyl-5-hydroxy-4-[[3-(trifluoromethyl)benzyl]thio]-2-pyrrolin-3-one Formula: C19H16F3NO2S MolecularWeight: 379.39605

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1CC2=CC=CC=C2)O)SCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1C(=O)C(=C(N1CC2=CC=CC=C2)O)SCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H16F3NO2S/c20-19(21,22)15-8-4-7-14(9-15)12-26-17-16(24)11-23(18(17)25)10-13-5-2-1-3-6-13/h1-9,25H,10-12H2