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

Systemtic Name: N-[(4-fluorophenyl)methyl]-2,4-dimethyl-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide Openeye Name: N-[(4-fluorophenyl)methyl]-2,4-dimethyl-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide CAS Name: N-[(4-fluorophenyl)methyl]-2,4-dimethyl-N-[2-oxo-2-(1-piperazinyl)ethyl]benzenesulfonamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2,4-dimethyl-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide Traditional Name: N-(4-fluorobenzyl)-N-(2-keto-2-piperazino-ethyl)-2,4-dimethyl-benzenesulfonamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC(=O)N3CCNCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC(=O)N3CCNCC3)C

InChI

InChI=1S/C21H26FN3O3S/c1-16-3-8-20(17(2)13-16)29(27,28)25(14-18-4-6-19(22)7-5-18)15-21(26)24-11-9-23-10-12-24/h3-8,13,23H,9-12,14-15H2,1-2H3