3-(2-cyclohexyl-5-propan-2-yl-phenyl)sulfanyl-2-oxidanyl-6-phenyl-pyran-4-one

Systemtic Name: 3-(2-cyclohexyl-5-propan-2-yl-phenyl)sulfanyl-2-oxidanyl-6-phenyl-pyran-4-one Openeye Name: 3-(2-cyclohexyl-5-isopropyl-phenyl)sulfanyl-2-hydroxy-6-phenyl-pyran-4-one CAS Name: 3-[(2-cyclohexyl-5-propan-2-ylphenyl)thio]-2-hydroxy-6-phenyl-4-pyranone IUPAC Name: 3-(2-cyclohexyl-5-propan-2-ylphenyl)sulfanyl-2-hydroxy-6-phenylpyran-4-one Traditional Name: 3-[(2-cyclohexyl-5-isopropyl-phenyl)thio]-2-hydroxy-6-phenyl-pyran-4-one Formula: C26H28O3S MolecularWeight: 420.56372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C=C1)C2CCCCC2)SC3=C(OC(=CC3=O)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)C1=CC(=C(C=C1)C2CCCCC2)SC3=C(OC(=CC3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C26H28O3S/c1-17(2)20-13-14-21(18-9-5-3-6-10-18)24(15-20)30-25-22(27)16-23(29-26(25)28)19-11-7-4-8-12-19/h4,7-8,11-18,28H,3,5-6,9-10H2,1-2H3