5-(3-bromanyl-4-methylsulfanyl-phenyl)-4-(3-fluorophenyl)-2,2-dimethyl-furan-3-one

Systemtic Name: 5-(3-bromanyl-4-methylsulfanyl-phenyl)-4-(3-fluorophenyl)-2,2-dimethyl-furan-3-one Openeye Name: 5-(3-bromo-4-methylsulfanyl-phenyl)-4-(3-fluorophenyl)-2,2-dimethyl-furan-3-one CAS Name: 5-[3-bromo-4-(methylthio)phenyl]-4-(3-fluorophenyl)-2,2-dimethyl-3-furanone IUPAC Name: 5-(3-bromo-4-methylsulfanylphenyl)-4-(3-fluorophenyl)-2,2-dimethylfuran-3-one Traditional Name: 5-[3-bromo-4-(methylthio)phenyl]-4-(3-fluorophenyl)-2,2-dimethyl-furan-3-one Formula: C19H16BrFO2S MolecularWeight: 407.296543

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C(=C(O1)C2=CC(=C(C=C2)SC)Br)C3=CC(=CC=C3)F)C

Isomeric SMILES

CC1(C(=O)C(=C(O1)C2=CC(=C(C=C2)SC)Br)C3=CC(=CC=C3)F)C

InChI

InChI=1S/C19H16BrFO2S/c1-19(2)18(22)16(11-5-4-6-13(21)9-11)17(23-19)12-7-8-15(24-3)14(20)10-12/h4-10H,1-3H3