N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N,2,5-trimethyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N,2,5-trimethyl-benzenesulfonamide Openeye Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]-N,2,5-trimethyl-benzenesulfonamide CAS Name: N-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-N,2,5-trimethylbenzenesulfonamide IUPAC Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-N,2,5-trimethylbenzenesulfonamide Traditional Name: N-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]-N,2,5-trimethyl-benzenesulfonamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N(C)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N(C)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3O3S/c1-16-4-5-17(2)20(14-16)29(27,28)23(3)15-21(26)25-12-10-24(11-13-25)19-8-6-18(22)7-9-19/h4-9,14H,10-13,15H2,1-3H3