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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1F)NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CC=C1F)NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26FN3O4S/c1-17(19-9-5-6-10-20(19)23)24-21(27)11-12-22(28)25-13-15-26(16-14-25)31(29,30)18-7-3-2-4-8-18/h2-10,17H,11-16H2,1H3,(H,24,27)