(2S)-4-[4-(4-chlorophenyl)phenyl]-4-oxidanylidene-2-(phenylsulfanylmethyl)butanoate

Systemtic Name: (2S)-4-[4-(4-chlorophenyl)phenyl]-4-oxidanylidene-2-(phenylsulfanylmethyl)butanoate Openeye Name: (2S)-4-[4-(4-chlorophenyl)phenyl]-4-oxo-2-(phenylsulfanylmethyl)butanoate CAS Name: (2S)-4-[4-(4-chlorophenyl)phenyl]-4-oxo-2-[(phenylthio)methyl]butanoate IUPAC Name: (2S)-4-[4-(4-chlorophenyl)phenyl]-4-oxo-2-(phenylsulfanylmethyl)butanoate Traditional Name: (2S)-4-[4-(4-chlorophenyl)phenyl]-4-keto-2-[(phenylthio)methyl]butyrate Formula: C23H18ClO3S- MolecularWeight: 409.90522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(CC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SC[C@@H](CC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C23H19ClO3S/c24-20-12-10-17(11-13-20)16-6-8-18(9-7-16)22(25)14-19(23(26)27)15-28-21-4-2-1-3-5-21/h1-13,19H,14-15H2,(H,26,27)/p-1/t19-/m1/s1