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

Systemtic Name: N-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-N-phenyl-methanesulfonamide Openeye Name: N-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-butyl]-N-phenyl-methanesulfonamide CAS Name: N-[4-[4-(4-fluorophenyl)-1-piperazinyl]-4-oxobutyl]-N-phenylmethanesulfonamide IUPAC Name: N-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutyl]-N-phenylmethanesulfonamide Traditional Name: N-[4-[4-(4-fluorophenyl)piperazino]-4-keto-butyl]-N-phenyl-methanesulfonamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26FN3O3S/c1-29(27,28)25(20-6-3-2-4-7-20)13-5-8-21(26)24-16-14-23(15-17-24)19-11-9-18(22)10-12-19/h2-4,6-7,9-12H,5,8,13-17H2,1H3