5-(4-methyl-2-propan-2-yl-phenyl)sulfanyl-6-oxidanyl-2-phenethyl-2-phenyl-3H-pyran-4-one

Systemtic Name: 5-(4-methyl-2-propan-2-yl-phenyl)sulfanyl-6-oxidanyl-2-phenethyl-2-phenyl-3H-pyran-4-one Openeye Name: 6-hydroxy-5-(2-isopropyl-4-methyl-phenyl)sulfanyl-2-phenethyl-2-phenyl-3H-pyran-4-one CAS Name: 6-hydroxy-5-[(4-methyl-2-propan-2-ylphenyl)thio]-2-phenethyl-2-phenyl-3H-pyran-4-one IUPAC Name: 6-hydroxy-5-(4-methyl-2-propan-2-ylphenyl)sulfanyl-2-phenethyl-2-phenyl-3H-pyran-4-one Traditional Name: 6-hydroxy-5-[(2-isopropyl-4-methyl-phenyl)thio]-2-phenethyl-2-phenyl-3H-pyran-4-one Formula: C29H30O3S MolecularWeight: 458.6117

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC2=C(OC(CC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4)O)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)SC2=C(OC(CC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4)O)C(C)C

InChI

InChI=1S/C29H30O3S/c1-20(2)24-18-21(3)14-15-26(24)33-27-25(30)19-29(32-28(27)31,23-12-8-5-9-13-23)17-16-22-10-6-4-7-11-22/h4-15,18,20,31H,16-17,19H2,1-3H3