N-[2-(3-fluorophenyl)ethyl]-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide

Systemtic Name: N-[2-(3-fluorophenyl)ethyl]-4-oxidanylidene-4-[4-(phenylsulfonyl)piperazin-1-yl]butanamide Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-[2-(3-fluorophenyl)ethyl]-4-oxo-butanamide CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]-N-[2-(3-fluorophenyl)ethyl]-4-oxobutanamide IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]-N-[2-(3-fluorophenyl)ethyl]-4-oxobutanamide Traditional Name: 4-(4-besylpiperazino)-N-[2-(3-fluorophenyl)ethyl]-4-keto-butyramide Formula: C22H26FN3O4S MolecularWeight: 447.522943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCC(=O)NCCC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CCC(=O)NCCC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26FN3O4S/c23-19-6-4-5-18(17-19)11-12-24-21(27)9-10-22(28)25-13-15-26(16-14-25)31(29,30)20-7-2-1-3-8-20/h1-8,17H,9-16H2,(H,24,27)