N-(4-fluorophenyl)-N-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butyl]methanesulfonamide

Systemtic Name: N-(4-fluorophenyl)-N-[4-oxidanylidene-4-[4-(phenylmethyl)piperazin-1-yl]butyl]methanesulfonamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)-4-oxo-butyl]-N-(4-fluorophenyl)methanesulfonamide CAS Name: N-(4-fluorophenyl)-N-[4-oxo-4-[4-(phenylmethyl)-1-piperazinyl]butyl]methanesulfonamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)-4-oxobutyl]-N-(4-fluorophenyl)methanesulfonamide Traditional Name: N-[4-(4-benzylpiperazino)-4-keto-butyl]-N-(4-fluorophenyl)methanesulfonamide Formula: C22H28FN3O3S MolecularWeight: 433.539423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)N1CCN(CC1)CC2=CC=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)N1CCN(CC1)CC2=CC=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H28FN3O3S/c1-30(28,29)26(21-11-9-20(23)10-12-21)13-5-8-22(27)25-16-14-24(15-17-25)18-19-6-3-2-4-7-19/h2-4,6-7,9-12H,5,8,13-18H2,1H3