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

Systemtic Name: 5-[2-tert-butyl-4-(2-hydroxyethyloxy)-5-methyl-phenyl]sulfanyl-6-oxidanyl-2-phenethyl-2-propan-2-yl-3H-pyran-4-one Openeye Name: 5-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methyl-phenyl]sulfanyl-6-hydroxy-2-isopropyl-2-phenethyl-3H-pyran-4-one CAS Name: 5-[[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]thio]-6-hydroxy-2-phenethyl-2-propan-2-yl-3H-pyran-4-one IUPAC Name: 5-[2-tert-butyl-4-(2-hydroxyethoxy)-5-methylphenyl]sulfanyl-6-hydroxy-2-phenethyl-2-propan-2-yl-3H-pyran-4-one Traditional Name: 5-[[2-tert-butyl-4-(2-hydroxyethoxy)-5-methyl-phenyl]thio]-6-hydroxy-2-isopropyl-2-phenethyl-3H-pyran-4-one Formula: C29H38O5S MolecularWeight: 498.67402

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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)C(C)C)O)C(C)(C)C)OCCO

Isomeric SMILES

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

InChI

InChI=1S/C29H38O5S/c1-19(2)29(13-12-21-10-8-7-9-11-21)18-23(31)26(27(32)34-29)35-25-16-20(3)24(33-15-14-30)17-22(25)28(4,5)6/h7-11,16-17,19,30,32H,12-15,18H2,1-6H3