3-[3-(4-tert-butylphenyl)sulfanyl-5-fluoranyl-phenyl]-4-methoxy-2-methyl-oxane

Systemtic Name: 3-[3-(4-tert-butylphenyl)sulfanyl-5-fluoranyl-phenyl]-4-methoxy-2-methyl-oxane Openeye Name: 3-[3-(4-tert-butylphenyl)sulfanyl-5-fluoro-phenyl]-4-methoxy-2-methyl-tetrahydropyran CAS Name: 3-[3-[(4-tert-butylphenyl)thio]-5-fluorophenyl]-4-methoxy-2-methyloxane IUPAC Name: 3-[3-(4-tert-butylphenyl)sulfanyl-5-fluorophenyl]-4-methoxy-2-methyloxane Traditional Name: 3-[3-[(4-tert-butylphenyl)thio]-5-fluoro-phenyl]-4-methoxy-2-methyl-tetrahydropyran Formula: C23H29FO2S MolecularWeight: 388.538563

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CCO1)OC)C2=CC(=CC(=C2)SC3=CC=C(C=C3)C(C)(C)C)F

Isomeric SMILES

CC1C(C(CCO1)OC)C2=CC(=CC(=C2)SC3=CC=C(C=C3)C(C)(C)C)F

InChI

InChI=1S/C23H29FO2S/c1-15-22(21(25-5)10-11-26-15)16-12-18(24)14-20(13-16)27-19-8-6-17(7-9-19)23(2,3)4/h6-9,12-15,21-22H,10-11H2,1-5H3