3-[[4-(3-chloranyl-4-fluoranyl-phenyl)phenyl]methyl]-1-methyl-4-(2-methylsulfanylethoxy)quinolin-2-one

Systemtic Name: 3-[[4-(3-chloranyl-4-fluoranyl-phenyl)phenyl]methyl]-1-methyl-4-(2-methylsulfanylethoxy)quinolin-2-one Openeye Name: 3-[[4-(3-chloro-4-fluoro-phenyl)phenyl]methyl]-1-methyl-4-(2-methylsulfanylethoxy)quinolin-2-one CAS Name: 3-[[4-(3-chloro-4-fluorophenyl)phenyl]methyl]-1-methyl-4-[2-(methylthio)ethoxy]-2-quinolinone IUPAC Name: 3-[[4-(3-chloro-4-fluorophenyl)phenyl]methyl]-1-methyl-4-(2-methylsulfanylethoxy)quinolin-2-one Traditional Name: 3-[4-(3-chloro-4-fluoro-phenyl)benzyl]-1-methyl-4-[2-(methylthio)ethoxy]carbostyril Formula: C26H23ClFNO2S MolecularWeight: 467.982723

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C(C1=O)CC3=CC=C(C=C3)C4=CC(=C(C=C4)F)Cl)OCCSC

Isomeric SMILES

CN1C2=CC=CC=C2C(=C(C1=O)CC3=CC=C(C=C3)C4=CC(=C(C=C4)F)Cl)OCCSC

InChI

InChI=1S/C26H23ClFNO2S/c1-29-24-6-4-3-5-20(24)25(31-13-14-32-2)21(26(29)30)15-17-7-9-18(10-8-17)19-11-12-23(28)22(27)16-19/h3-12,16H,13-15H2,1-2H3