1-(furan-2-yl)-3-phenylsulfanyl-3-(3,4,5-trimethoxyphenyl)propan-1-one

Systemtic Name: 1-(furan-2-yl)-3-phenylsulfanyl-3-(3,4,5-trimethoxyphenyl)propan-1-one Openeye Name: 1-(2-furyl)-3-phenylsulfanyl-3-(3,4,5-trimethoxyphenyl)propan-1-one CAS Name: 1-(2-furanyl)-3-(phenylthio)-3-(3,4,5-trimethoxyphenyl)-1-propanone IUPAC Name: 1-(furan-2-yl)-3-phenylsulfanyl-3-(3,4,5-trimethoxyphenyl)propan-1-one Traditional Name: 1-(2-furyl)-3-(phenylthio)-3-(3,4,5-trimethoxyphenyl)propan-1-one Formula: C22H22O5S MolecularWeight: 398.47208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(CC(=O)C2=CC=CO2)SC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(CC(=O)C2=CC=CO2)SC3=CC=CC=C3

InChI

InChI=1S/C22H22O5S/c1-24-19-12-15(13-20(25-2)22(19)26-3)21(28-16-8-5-4-6-9-16)14-17(23)18-10-7-11-27-18/h4-13,21H,14H2,1-3H3