7-[3-fluoranyl-5-(4-methoxyoxan-4-yl)-4-methyl-phenyl]sulfanyl-4-methyl-1,4-benzoxazin-3-one

Systemtic Name: 7-[3-fluoranyl-5-(4-methoxyoxan-4-yl)-4-methyl-phenyl]sulfanyl-4-methyl-1,4-benzoxazin-3-one Openeye Name: 7-[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)-4-methyl-phenyl]sulfanyl-4-methyl-1,4-benzoxazin-3-one CAS Name: 7-[[3-fluoro-5-(4-methoxy-4-oxanyl)-4-methylphenyl]thio]-4-methyl-1,4-benzoxazin-3-one IUPAC Name: 7-[3-fluoro-5-(4-methoxyoxan-4-yl)-4-methylphenyl]sulfanyl-4-methyl-1,4-benzoxazin-3-one Traditional Name: 7-[[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)-4-methyl-phenyl]thio]-4-methyl-1,4-benzoxazin-3-one Formula: C22H24FNO4S MolecularWeight: 417.493663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C2(CCOCC2)OC)SC3=CC4=C(C=C3)N(C(=O)CO4)C)F

Isomeric SMILES

CC1=C(C=C(C=C1C2(CCOCC2)OC)SC3=CC4=C(C=C3)N(C(=O)CO4)C)F

InChI

InChI=1S/C22H24FNO4S/c1-14-17(22(26-3)6-8-27-9-7-22)10-16(11-18(14)23)29-15-4-5-19-20(12-15)28-13-21(25)24(19)2/h4-5,10-12H,6-9,13H2,1-3H3