7-[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenyl]sulfanyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenyl]sulfanyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one Openeye Name: 7-[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenyl]sulfanyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one CAS Name: 7-[[3-fluoro-5-(4-methoxy-4-oxanyl)phenyl]thio]-2,2-dimethyl-4H-1,4-benzoxazin-3-one IUPAC Name: 7-[3-fluoro-5-(4-methoxyoxan-4-yl)phenyl]sulfanyl-2,2-dimethyl-4H-1,4-benzoxazin-3-one Traditional Name: 7-[[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenyl]thio]-2,2-dimethyl-4H-1,4-benzoxazin-3-one Formula: C22H24FNO4S MolecularWeight: 417.493663

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=C(O1)C=C(C=C2)SC3=CC(=CC(=C3)F)C4(CCOCC4)OC)C

Isomeric SMILES

CC1(C(=O)NC2=C(O1)C=C(C=C2)SC3=CC(=CC(=C3)F)C4(CCOCC4)OC)C

InChI

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