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

Systemtic Name: 5-[2-tert-butyl-4-(2-hydroxyethyl)-5-methyl-phenyl]sulfanyl-6-oxidanyl-2-propan-2-yl-2-(2-thiophen-3-ylethyl)-3H-pyran-4-one Openeye Name: 5-[2-tert-butyl-4-(2-hydroxyethyl)-5-methyl-phenyl]sulfanyl-6-hydroxy-2-isopropyl-2-[2-(3-thienyl)ethyl]-3H-pyran-4-one CAS Name: 5-[[2-tert-butyl-4-(2-hydroxyethyl)-5-methylphenyl]thio]-6-hydroxy-2-propan-2-yl-2-[2-(3-thiophenyl)ethyl]-3H-pyran-4-one IUPAC Name: 5-[2-tert-butyl-4-(2-hydroxyethyl)-5-methylphenyl]sulfanyl-6-hydroxy-2-propan-2-yl-2-(2-thiophen-3-ylethyl)-3H-pyran-4-one Traditional Name: 5-[[2-tert-butyl-4-(2-hydroxyethyl)-5-methyl-phenyl]thio]-6-hydroxy-2-isopropyl-2-[2-(3-thienyl)ethyl]-3H-pyran-4-one Formula: C27H36O4S2 MolecularWeight: 488.70234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CCO)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CSC=C3)C(C)C)O

Isomeric SMILES

CC1=CC(=C(C=C1CCO)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CSC=C3)C(C)C)O

InChI

InChI=1S/C27H36O4S2/c1-17(2)27(10-7-19-9-12-32-16-19)15-22(29)24(25(30)31-27)33-23-13-18(3)20(8-11-28)14-21(23)26(4,5)6/h9,12-14,16-17,28,30H,7-8,10-11,15H2,1-6H3