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

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-(furan-2-yl)-3-(3,4,5-trimethoxyphenyl)propan-1-one Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-(2-furyl)-3-(3,4,5-trimethoxyphenyl)propan-1-one CAS Name: 3-[(4-chlorophenyl)thio]-1-(2-furanyl)-3-(3,4,5-trimethoxyphenyl)-1-propanone IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-(furan-2-yl)-3-(3,4,5-trimethoxyphenyl)propan-1-one Traditional Name: 3-[(4-chlorophenyl)thio]-1-(2-furyl)-3-(3,4,5-trimethoxyphenyl)propan-1-one Formula: C22H21ClO5S MolecularWeight: 432.91714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClO5S/c1-25-19-11-14(12-20(26-2)22(19)27-3)21(13-17(24)18-5-4-10-28-18)29-16-8-6-15(23)7-9-16/h4-12,21H,13H2,1-3H3