2-[2-(2-methyl-5-oxidanyl-phenyl)ethyl]-6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-3H-pyran-4-one

Systemtic Name: 2-[2-(2-methyl-5-oxidanyl-phenyl)ethyl]-6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-3H-pyran-4-one Openeye Name: 5-benzylsulfanyl-6-hydroxy-2-[2-(5-hydroxy-2-methyl-phenyl)ethyl]-2-phenyl-3H-pyran-4-one CAS Name: 6-hydroxy-2-[2-(5-hydroxy-2-methylphenyl)ethyl]-2-phenyl-5-(phenylmethylthio)-3H-pyran-4-one IUPAC Name: 5-benzylsulfanyl-6-hydroxy-2-[2-(5-hydroxy-2-methylphenyl)ethyl]-2-phenyl-3H-pyran-4-one Traditional Name: 5-(benzylthio)-6-hydroxy-2-[2-(5-hydroxy-2-methyl-phenyl)ethyl]-2-phenyl-3H-pyran-4-one Formula: C27H26O4S MolecularWeight: 446.55794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)O)CCC2(CC(=O)C(=C(O2)O)SCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)O)CCC2(CC(=O)C(=C(O2)O)SCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26O4S/c1-19-12-13-23(28)16-21(19)14-15-27(22-10-6-3-7-11-22)17-24(29)25(26(30)31-27)32-18-20-8-4-2-5-9-20/h2-13,16,28,30H,14-15,17-18H2,1H3