N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2,4,6-trimethyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-2,4,6-trimethyl-benzenesulfonamide Openeye Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]-2,4,6-trimethyl-benzenesulfonamide CAS Name: N-[2-[4-(2-fluorophenyl)-1-piperazinyl]-2-oxoethyl]-2,4,6-trimethylbenzenesulfonamide IUPAC Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-2,4,6-trimethylbenzenesulfonamide Traditional Name: N-[2-[4-(2-fluorophenyl)piperazino]-2-keto-ethyl]-2,4,6-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)NCC(=O)N2CCN(CC2)C3=CC=CC=C3F)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC(=O)N2CCN(CC2)C3=CC=CC=C3F)C

InChI

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