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

Systemtic Name: 5-(2-tert-butyl-5-methyl-phenyl)sulfanyl-2-[4-(2-hydroxyethyloxy)phenyl]-6-oxidanyl-2-phenethyl-3H-pyran-4-one Openeye Name: 5-(2-tert-butyl-5-methyl-phenyl)sulfanyl-6-hydroxy-2-[4-(2-hydroxyethoxy)phenyl]-2-phenethyl-3H-pyran-4-one CAS Name: 5-[(2-tert-butyl-5-methylphenyl)thio]-6-hydroxy-2-[4-(2-hydroxyethoxy)phenyl]-2-phenethyl-3H-pyran-4-one IUPAC Name: 5-(2-tert-butyl-5-methylphenyl)sulfanyl-6-hydroxy-2-[4-(2-hydroxyethoxy)phenyl]-2-phenethyl-3H-pyran-4-one Traditional Name: 5-[(2-tert-butyl-5-methyl-phenyl)thio]-6-hydroxy-2-[4-(2-hydroxyethoxy)phenyl]-2-phenethyl-3H-pyran-4-one Formula: C32H36O5S MolecularWeight: 532.69024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H36O5S/c1-22-10-15-26(31(2,3)4)28(20-22)38-29-27(34)21-32(37-30(29)35,17-16-23-8-6-5-7-9-23)24-11-13-25(14-12-24)36-19-18-33/h5-15,20,33,35H,16-19,21H2,1-4H3