5-(2-tert-butyl-4-methoxy-5-methyl-phenyl)sulfanyl-6-oxidanyl-2-phenethyl-2-phenyl-3H-pyran-4-one

Systemtic Name: 5-(2-tert-butyl-4-methoxy-5-methyl-phenyl)sulfanyl-6-oxidanyl-2-phenethyl-2-phenyl-3H-pyran-4-one Openeye Name: 5-(2-tert-butyl-4-methoxy-5-methyl-phenyl)sulfanyl-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one CAS Name: 5-[(2-tert-butyl-4-methoxy-5-methylphenyl)thio]-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one IUPAC Name: 5-(2-tert-butyl-4-methoxy-5-methylphenyl)sulfanyl-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one Traditional Name: 5-[(2-tert-butyl-4-methoxy-5-methyl-phenyl)thio]-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one Formula: C31H34O4S MolecularWeight: 502.66426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H34O4S/c1-21-18-27(24(30(2,3)4)19-26(21)34-5)36-28-25(32)20-31(35-29(28)33,23-14-10-7-11-15-23)17-16-22-12-8-6-9-13-22/h6-15,18-19,33H,16-17,20H2,1-5H3