5-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-2-cyclohexyl-6-oxidanyl-2-(2-thiophen-2-ylethyl)-3H-pyran-4-one

Systemtic Name: 5-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-2-cyclohexyl-6-oxidanyl-2-(2-thiophen-2-ylethyl)-3H-pyran-4-one Openeye Name: 5-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-2-cyclohexyl-6-hydroxy-2-[2-(2-thienyl)ethyl]-3H-pyran-4-one CAS Name: 5-[[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]thio]-2-cyclohexyl-6-hydroxy-2-(2-thiophen-2-ylethyl)-3H-pyran-4-one IUPAC Name: 5-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-2-cyclohexyl-6-hydroxy-2-(2-thiophen-2-ylethyl)-3H-pyran-4-one Traditional Name: 5-[(2-tert-butyl-5-methyl-4-methylol-phenyl)thio]-2-cyclohexyl-6-hydroxy-2-[2-(2-thienyl)ethyl]-3H-pyran-4-one Formula: C29H38O4S2 MolecularWeight: 514.73962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CO)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CC=CS3)C4CCCCC4)O

Isomeric SMILES

CC1=CC(=C(C=C1CO)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CC=CS3)C4CCCCC4)O

InChI

InChI=1S/C29H38O4S2/c1-19-15-25(23(28(2,3)4)16-20(19)18-30)35-26-24(31)17-29(33-27(26)32,21-9-6-5-7-10-21)13-12-22-11-8-14-34-22/h8,11,14-16,21,30,32H,5-7,9-10,12-13,17-18H2,1-4H3