4-fluoranyl-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)-N-(2-phenylpropyl)benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)-N-(2-phenylpropyl)benzenesulfonamide Openeye Name: 4-fluoro-N-(2-oxo-2-piperazin-1-yl-ethyl)-N-(2-phenylpropyl)benzenesulfonamide CAS Name: 4-fluoro-N-[2-oxo-2-(1-piperazinyl)ethyl]-N-(2-phenylpropyl)benzenesulfonamide IUPAC Name: 4-fluoro-N-(2-oxo-2-piperazin-1-ylethyl)-N-(2-phenylpropyl)benzenesulfonamide Traditional Name: 4-fluoro-N-(2-keto-2-piperazino-ethyl)-N-(2-phenylpropyl)benzenesulfonamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC(=O)N1CCNCC1)S(=O)(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CC(CN(CC(=O)N1CCNCC1)S(=O)(=O)C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C21H26FN3O3S/c1-17(18-5-3-2-4-6-18)15-25(16-21(26)24-13-11-23-12-14-24)29(27,28)20-9-7-19(22)8-10-20/h2-10,17,23H,11-16H2,1H3