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

Systemtic Name: N-[(4-fluorophenyl)methyl]-2,4,5-trimethyl-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide Openeye Name: N-[(4-fluorophenyl)methyl]-2,4,5-trimethyl-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide CAS Name: N-[(4-fluorophenyl)methyl]-2,4,5-trimethyl-N-[2-oxo-2-(1-piperazinyl)ethyl]benzenesulfonamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2,4,5-trimethyl-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide Traditional Name: N-(4-fluorobenzyl)-N-(2-keto-2-piperazino-ethyl)-2,4,5-trimethyl-benzenesulfonamide Formula: C22H28FN3O3S MolecularWeight: 433.539423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC(=O)N3CCNCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1C)S(=O)(=O)N(CC2=CC=C(C=C2)F)CC(=O)N3CCNCC3)C

InChI

InChI=1S/C22H28FN3O3S/c1-16-12-18(3)21(13-17(16)2)30(28,29)26(14-19-4-6-20(23)7-5-19)15-22(27)25-10-8-24-9-11-25/h4-7,12-13,24H,8-11,14-15H2,1-3H3