3-chloranyl-2-fluoranyl-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-yl]benzenesulfonamide

Systemtic Name: 3-chloranyl-2-fluoranyl-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-yl]benzenesulfonamide Openeye Name: 3-chloro-2-fluoro-N-[1-methyl-3-[4-(m-tolyl)piperazin-1-yl]propyl]benzenesulfonamide CAS Name: 3-chloro-2-fluoro-N-[4-[4-(3-methylphenyl)-1-piperazinyl]butan-2-yl]benzenesulfonamide IUPAC Name: 3-chloro-2-fluoro-N-[4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-yl]benzenesulfonamide Traditional Name: 3-chloro-2-fluoro-N-[1-methyl-3-[4-(m-tolyl)piperazino]propyl]benzenesulfonamide Formula: C21H27ClFN3O2S MolecularWeight: 439.974383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCC(C)NS(=O)(=O)C3=C(C(=CC=C3)Cl)F

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCC(C)NS(=O)(=O)C3=C(C(=CC=C3)Cl)F

InChI

InChI=1S/C21H27ClFN3O2S/c1-16-5-3-6-18(15-16)26-13-11-25(12-14-26)10-9-17(2)24-29(27,28)20-8-4-7-19(22)21(20)23/h3-8,15,17,24H,9-14H2,1-2H3