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

Systemtic Name: 5-[2-tert-butyl-4-(2-hydroxyethyloxy)-5-methyl-phenyl]sulfanyl-2-[4-(2-hydroxyethyloxy)phenyl]-6-oxidanyl-2-phenethyl-3H-pyran-4-one Openeye Name: 5-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methyl-phenyl]sulfanyl-6-hydroxy-2-[4-(2-hydroxyethoxy)phenyl]-2-phenethyl-3H-pyran-4-one CAS Name: 5-[[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]thio]-6-hydroxy-2-[4-(2-hydroxyethoxy)phenyl]-2-phenethyl-3H-pyran-4-one IUPAC Name: 5-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-6-hydroxy-2-[4-(2-hydroxyethoxy)phenyl]-2-phenethyl-3H-pyran-4-one Traditional Name: 5-[[2-tert-butyl-4-(2-hydroxyethoxy)-5-methyl-phenyl]thio]-6-hydroxy-2-[4-(2-hydroxyethoxy)phenyl]-2-phenethyl-3H-pyran-4-one Formula: C34H40O7S MolecularWeight: 592.7422

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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=C(C=C4)OCCO)O)C(C)(C)C)OCCO

Isomeric SMILES

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

InChI

InChI=1S/C34H40O7S/c1-23-20-30(27(33(2,3)4)21-29(23)40-19-17-36)42-31-28(37)22-34(41-32(31)38,15-14-24-8-6-5-7-9-24)25-10-12-26(13-11-25)39-18-16-35/h5-13,20-21,35-36,38H,14-19,22H2,1-4H3