1-(4-chlorophenyl)-4-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-chlorophenyl)-4-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-chlorophenyl)-4-[4-[2-oxo-2-(2-thienyl)ethyl]piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-chlorophenyl)-4-[4-(2-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-chlorophenyl)-4-[4-(2-oxo-2-thiophen-2-ylethyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(4-chlorophenyl)-4-[4-[2-keto-2-(2-thienyl)ethyl]piperazino]butane-1,4-dione Formula: C20H21ClN2O3S MolecularWeight: 404.91034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)CCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)CCC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN2O3S/c21-16-5-3-15(4-6-16)17(24)7-8-20(26)23-11-9-22(10-12-23)14-18(25)19-2-1-13-27-19/h1-6,13H,7-12,14H2