N-(3,5-dimethylphenyl)-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide

Systemtic Name: N-(3,5-dimethylphenyl)-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide Openeye Name: N-(3,5-dimethylphenyl)-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]methanesulfonamide CAS Name: N-(3,5-dimethylphenyl)-N-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-oxoethyl]methanesulfonamide IUPAC Name: N-(3,5-dimethylphenyl)-N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-oxoethyl]methanesulfonamide Traditional Name: N-(3,5-dimethylphenyl)-N-[2-[4-(4-fluorophenyl)piperazino]-2-keto-ethyl]methanesulfonamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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