N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-(3-pyridyl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-[4-(2-fluorophenyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-pyridin-3-ylethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-[4-(2-fluorophenyl)piperazino]-2-(3-pyridyl)ethyl]-4-nitro-benzenesulfonamide Formula: C23H24FN5O4S MolecularWeight: 485.531163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CN=CC=C4

InChI

InChI=1S/C23H24FN5O4S/c24-21-5-1-2-6-22(21)27-12-14-28(15-13-27)23(18-4-3-11-25-16-18)17-26-34(32,33)20-9-7-19(8-10-20)29(30)31/h1-11,16,23,26H,12-15,17H2