N-[4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]-4-fluoranyl-N-methyl-benzenesulfonamide

Systemtic Name: N-[4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]-4-fluoranyl-N-methyl-benzenesulfonamide Openeye Name: N-[4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4-oxo-butyl]-4-fluoro-N-methyl-benzenesulfonamide CAS Name: N-[4-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-4-oxobutyl]-4-fluoro-N-methylbenzenesulfonamide IUPAC Name: N-[4-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-4-oxobutyl]-4-fluoro-N-methylbenzenesulfonamide Traditional Name: N-[4-[4-(4-chlorobenzyl)piperazino]-4-keto-butyl]-4-fluoro-N-methyl-benzenesulfonamide Formula: C22H27ClFN3O3S MolecularWeight: 467.984483

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)N1CCN(CC1)CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CCCC(=O)N1CCN(CC1)CC2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H27ClFN3O3S/c1-25(31(29,30)21-10-8-20(24)9-11-21)12-2-3-22(28)27-15-13-26(14-16-27)17-18-4-6-19(23)7-5-18/h4-11H,2-3,12-17H2,1H3