6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-2-propyl-3H-pyran-4-one

Systemtic Name: 6-oxidanyl-2-phenyl-5-(phenylmethylsulfanyl)-2-propyl-3H-pyran-4-one Openeye Name: 5-benzylsulfanyl-6-hydroxy-2-phenyl-2-propyl-3H-pyran-4-one CAS Name: 6-hydroxy-2-phenyl-5-(phenylmethylthio)-2-propyl-3H-pyran-4-one IUPAC Name: 5-benzylsulfanyl-6-hydroxy-2-phenyl-2-propyl-3H-pyran-4-one Traditional Name: 5-(benzylthio)-6-hydroxy-2-phenyl-2-propyl-3H-pyran-4-one Formula: C21H22O3S MolecularWeight: 354.46258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(=O)C(=C(O1)O)SCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCC1(CC(=O)C(=C(O1)O)SCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22O3S/c1-2-13-21(17-11-7-4-8-12-17)14-18(22)19(20(23)24-21)25-15-16-9-5-3-6-10-16/h3-12,23H,2,13-15H2,1H3