1-(4-methylsulfanylphenyl)-4-(4-phenylpiperazin-1-yl)butane-1,4-dione

Systemtic Name: 1-(4-methylsulfanylphenyl)-4-(4-phenylpiperazin-1-yl)butane-1,4-dione Openeye Name: 1-(4-methylsulfanylphenyl)-4-(4-phenylpiperazin-1-yl)butane-1,4-dione CAS Name: 1-[4-(methylthio)phenyl]-4-(4-phenyl-1-piperazinyl)butane-1,4-dione IUPAC Name: 1-(4-methylsulfanylphenyl)-4-(4-phenylpiperazin-1-yl)butane-1,4-dione Traditional Name: 1-[4-(methylthio)phenyl]-4-(4-phenylpiperazino)butane-1,4-dione Formula: C21H24N2O2S MolecularWeight: 368.49246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2S/c1-26-19-9-7-17(8-10-19)20(24)11-12-21(25)23-15-13-22(14-16-23)18-5-3-2-4-6-18/h2-10H,11-16H2,1H3