(2S)-4-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)-2-thiophen-2-yl-butane-1,4-dione

Systemtic Name: (2S)-4-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)-2-thiophen-2-yl-butane-1,4-dione Openeye Name: (2S)-4-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)-2-(2-thienyl)butane-1,4-dione CAS Name: (2S)-4-(4-chlorophenyl)-1-[4-(methylthio)phenyl]-2-thiophen-2-ylbutane-1,4-dione IUPAC Name: (2S)-4-(4-chlorophenyl)-1-(4-methylsulfanylphenyl)-2-thiophen-2-ylbutane-1,4-dione Traditional Name: (2S)-4-(4-chlorophenyl)-1-[4-(methylthio)phenyl]-2-(2-thienyl)butane-1,4-dione Formula: C21H17ClO2S2 MolecularWeight: 400.94148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)C(CC(=O)C2=CC=C(C=C2)Cl)C3=CC=CS3

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)[C@H](CC(=O)C2=CC=C(C=C2)Cl)C3=CC=CS3

InChI

InChI=1S/C21H17ClO2S2/c1-25-17-10-6-15(7-11-17)21(24)18(20-3-2-12-26-20)13-19(23)14-4-8-16(22)9-5-14/h2-12,18H,13H2,1H3/t18-/m1/s1