methyl 2,4-bis(phenylsulfanyl)benzoate

Systemtic Name: methyl 2,4-bis(phenylsulfanyl)benzoate Openeye Name: methyl 2,4-bis(phenylsulfanyl)benzoate CAS Name: 2,4-bis(phenylthio)benzoic acid methyl ester IUPAC Name: methyl 2,4-bis(phenylsulfanyl)benzoate Traditional Name: 2,4-bis(phenylthio)benzoic acid methyl ester Formula: C20H16O2S2 MolecularWeight: 352.46984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)SC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)SC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H16O2S2/c1-22-20(21)18-13-12-17(23-15-8-4-2-5-9-15)14-19(18)24-16-10-6-3-7-11-16/h2-14H,1H3