6-[3-fluoranyl-5-(oxan-4-ylcarbonyl)phenoxy]sulfanyl-1-methyl-quinolin-2-one

Systemtic Name: 6-[3-fluoranyl-5-(oxan-4-ylcarbonyl)phenoxy]sulfanyl-1-methyl-quinolin-2-one Openeye Name: 6-[3-fluoro-5-(tetrahydropyran-4-carbonyl)phenoxy]sulfanyl-1-methyl-quinolin-2-one CAS Name: 1-methyl-2-oxo-6-quinolinesulfenic acid [3-fluoro-5-[4-oxanyl(oxo)methyl]phenyl] ester IUPAC Name: 6-[3-fluoro-5-(oxane-4-carbonyl)phenoxy]sulfanyl-1-methylquinolin-2-one Traditional Name: 6-[[3-fluoro-5-(tetrahydropyran-4-carbonyl)phenoxy]thio]-1-methyl-carbostyril Formula: C22H20FNO4S MolecularWeight: 413.461903

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC1=O)C=C(C=C2)SOC3=CC(=CC(=C3)C(=O)C4CCOCC4)F

Isomeric SMILES

CN1C2=C(C=CC1=O)C=C(C=C2)SOC3=CC(=CC(=C3)C(=O)C4CCOCC4)F

InChI

InChI=1S/C22H20FNO4S/c1-24-20-4-3-19(12-15(20)2-5-21(24)25)29-28-18-11-16(10-17(23)13-18)22(26)14-6-8-27-9-7-14/h2-5,10-14H,6-9H2,1H3