5-[5-ethyl-2-(1-oxidanylpropan-2-yl)phenyl]-4-oxidanyl-6,6-diphenyl-3-sulfanylidene-oxan-2-one

Systemtic Name: 5-[5-ethyl-2-(1-oxidanylpropan-2-yl)phenyl]-4-oxidanyl-6,6-diphenyl-3-sulfanylidene-oxan-2-one Openeye Name: 5-[5-ethyl-2-(2-hydroxy-1-methyl-ethyl)phenyl]-4-hydroxy-6,6-diphenyl-3-thioxo-tetrahydropyran-2-one CAS Name: 5-[5-ethyl-2-(1-hydroxypropan-2-yl)phenyl]-4-hydroxy-6,6-diphenyl-3-sulfanylidene-2-oxanone IUPAC Name: 5-[5-ethyl-2-(1-hydroxypropan-2-yl)phenyl]-4-hydroxy-6,6-diphenyl-3-sulfanylideneoxan-2-one Traditional Name: 5-[5-ethyl-2-(2-hydroxy-1-methyl-ethyl)phenyl]-4-hydroxy-6,6-diphenyl-3-thioxo-tetrahydropyran-2-one Formula: C28H28O4S MolecularWeight: 460.58452

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)C(C)CO)C2C(C(=S)C(=O)OC2(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCC1=CC(=C(C=C1)C(C)CO)C2C(C(=S)C(=O)OC2(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C28H28O4S/c1-3-19-14-15-22(18(2)17-29)23(16-19)24-25(30)26(33)27(31)32-28(24,20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-16,18,24-25,29-30H,3,17H2,1-2H3