1-[4-[3-fluoranyl-5-(4-methoxy-2-methyl-oxan-4-yl)phenyl]sulfanylphenyl]ethanone

Systemtic Name: 1-[4-[3-fluoranyl-5-(4-methoxy-2-methyl-oxan-4-yl)phenyl]sulfanylphenyl]ethanone Openeye Name: 1-[4-[3-fluoro-5-(4-methoxy-2-methyl-tetrahydropyran-4-yl)phenyl]sulfanylphenyl]ethanone CAS Name: 1-[4-[[3-fluoro-5-(4-methoxy-2-methyl-4-oxanyl)phenyl]thio]phenyl]ethanone IUPAC Name: 1-[4-[3-fluoro-5-(4-methoxy-2-methyloxan-4-yl)phenyl]sulfanylphenyl]ethanone Traditional Name: 1-[4-[[3-fluoro-5-(4-methoxy-2-methyl-tetrahydropyran-4-yl)phenyl]thio]phenyl]ethanone Formula: C21H23FO3S MolecularWeight: 374.468923

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCO1)(C2=CC(=CC(=C2)SC3=CC=C(C=C3)C(=O)C)F)OC

Isomeric SMILES

CC1CC(CCO1)(C2=CC(=CC(=C2)SC3=CC=C(C=C3)C(=O)C)F)OC

InChI

InChI=1S/C21H23FO3S/c1-14-13-21(24-3,8-9-25-14)17-10-18(22)12-20(11-17)26-19-6-4-16(5-7-19)15(2)23/h4-7,10-12,14H,8-9,13H2,1-3H3