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

Systemtic Name: 2-[3-bromanyl-5-(4-tert-butylphenyl)sulfanyl-phenyl]-4-methoxy-oxane Openeye Name: 2-[3-bromo-5-(4-tert-butylphenyl)sulfanyl-phenyl]-4-methoxy-tetrahydropyran CAS Name: 2-[3-bromo-5-[(4-tert-butylphenyl)thio]phenyl]-4-methoxyoxane IUPAC Name: 2-[3-bromo-5-(4-tert-butylphenyl)sulfanylphenyl]-4-methoxyoxane Traditional Name: 2-[3-bromo-5-[(4-tert-butylphenyl)thio]phenyl]-4-methoxy-tetrahydropyran Formula: C22H27BrO2S MolecularWeight: 435.41758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC2=CC(=CC(=C2)C3CC(CCO3)OC)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC2=CC(=CC(=C2)C3CC(CCO3)OC)Br

InChI

InChI=1S/C22H27BrO2S/c1-22(2,3)16-5-7-19(8-6-16)26-20-12-15(11-17(23)13-20)21-14-18(24-4)9-10-25-21/h5-8,11-13,18,21H,9-10,14H2,1-4H3