5-fluoranyl-2-methyl-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]benzenesulfonamide

Systemtic Name: 5-fluoranyl-2-methyl-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]benzenesulfonamide Openeye Name: 5-fluoro-2-methyl-N-[3-[4-(m-tolyl)piperazin-1-yl]propyl]benzenesulfonamide CAS Name: 5-fluoro-2-methyl-N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]benzenesulfonamide IUPAC Name: 5-fluoro-2-methyl-N-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]benzenesulfonamide Traditional Name: 5-fluoro-2-methyl-N-[3-[4-(m-tolyl)piperazino]propyl]benzenesulfonamide Formula: C21H28FN3O2S MolecularWeight: 405.529323

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28FN3O2S/c1-17-5-3-6-20(15-17)25-13-11-24(12-14-25)10-4-9-23-28(26,27)21-16-19(22)8-7-18(21)2/h3,5-8,15-16,23H,4,9-14H2,1-2H3