6-(3-ethylphenyl)-2-oxidanyl-3-(phenylmethylsulfanyl)pyran-4-one

Systemtic Name: 6-(3-ethylphenyl)-2-oxidanyl-3-(phenylmethylsulfanyl)pyran-4-one Openeye Name: 3-benzylsulfanyl-6-(3-ethylphenyl)-2-hydroxy-pyran-4-one CAS Name: 6-(3-ethylphenyl)-2-hydroxy-3-(phenylmethylthio)-4-pyranone IUPAC Name: 3-benzylsulfanyl-6-(3-ethylphenyl)-2-hydroxypyran-4-one Traditional Name: 3-(benzylthio)-6-(3-ethylphenyl)-2-hydroxy-pyran-4-one Formula: C20H18O3S MolecularWeight: 338.42012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1)C2=CC(=O)C(=C(O2)O)SCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC(=C1)C2=CC(=O)C(=C(O2)O)SCC3=CC=CC=C3

InChI

InChI=1S/C20H18O3S/c1-2-14-9-6-10-16(11-14)18-12-17(21)19(20(22)23-18)24-13-15-7-4-3-5-8-15/h3-12,22H,2,13H2,1H3