[4-(5-sulfanylidene-1,2-dithiol-3-yl)phenyl] 2-[3-(phenylcarbonyl)phenyl]propanoate

Systemtic Name: [4-(5-sulfanylidene-1,2-dithiol-3-yl)phenyl] 2-[3-(phenylcarbonyl)phenyl]propanoate Openeye Name: [4-(5-thioxodithiol-3-yl)phenyl] 2-(3-benzoylphenyl)propanoate CAS Name: 2-(3-benzoylphenyl)propanoic acid [4-(5-sulfanylidene-3-dithiolyl)phenyl] ester IUPAC Name: [4-(5-sulfanylidenedithiol-3-yl)phenyl] 2-(3-benzoylphenyl)propanoate Traditional Name: 2-(3-benzoylphenyl)propionic acid [4-(5-thioxodithiol-3-yl)phenyl] ester Formula: C25H18O3S3 MolecularWeight: 462.60362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)OC3=CC=C(C=C3)C4=CC(=S)SS4

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)OC3=CC=C(C=C3)C4=CC(=S)SS4

InChI

InChI=1S/C25H18O3S3/c1-16(19-8-5-9-20(14-19)24(26)18-6-3-2-4-7-18)25(27)28-21-12-10-17(11-13-21)22-15-23(29)31-30-22/h2-16H,1H3