methyl 6-methylsulfanyl-2-oxidanylidene-4,5-diphenyl-pyran-3-carboxylate

Systemtic Name: methyl 6-methylsulfanyl-2-oxidanylidene-4,5-diphenyl-pyran-3-carboxylate Openeye Name: methyl 6-methylsulfanyl-2-oxo-4,5-diphenyl-pyran-3-carboxylate CAS Name: 6-(methylthio)-2-oxo-4,5-diphenyl-3-pyrancarboxylic acid methyl ester IUPAC Name: methyl 6-methylsulfanyl-2-oxo-4,5-diphenylpyran-3-carboxylate Traditional Name: 2-keto-6-(methylthio)-4,5-diphenyl-pyran-3-carboxylic acid methyl ester Formula: C20H16O4S MolecularWeight: 352.40364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(OC1=O)SC)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C(=C(OC1=O)SC)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H16O4S/c1-23-18(21)17-15(13-9-5-3-6-10-13)16(14-11-7-4-8-12-14)20(25-2)24-19(17)22/h3-12H,1-2H3