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

Systemtic Name: (2S)-5-(2-tert-butyl-5-methyl-phenyl)sulfanyl-6-oxidanyl-2-phenethyl-2-phenyl-3H-pyran-4-one Openeye Name: (2S)-5-(2-tert-butyl-5-methyl-phenyl)sulfanyl-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one CAS Name: (2S)-5-[(2-tert-butyl-5-methylphenyl)thio]-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one IUPAC Name: (2S)-5-(2-tert-butyl-5-methylphenyl)sulfanyl-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one Traditional Name: (2S)-5-[(2-tert-butyl-5-methyl-phenyl)thio]-6-hydroxy-2-phenethyl-2-phenyl-3H-pyran-4-one Formula: C30H32O3S MolecularWeight: 472.63828

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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=CC=C4)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)SC2=C(O[C@](CC2=O)(CCC3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C30H32O3S/c1-21-15-16-24(29(2,3)4)26(19-21)34-27-25(31)20-30(33-28(27)32,23-13-9-6-10-14-23)18-17-22-11-7-5-8-12-22/h5-16,19,32H,17-18,20H2,1-4H3/t30-/m0/s1