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

Systemtic Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(furan-2-yl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(2-furyl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-[4-(4-fluorophenyl)-1-piperazinyl]-2-(2-furanyl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(furan-2-yl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-[4-(4-fluorophenyl)piperazino]-2-(2-furyl)ethyl]-4-nitro-benzenesulfonamide Formula: C22H23FN4O5S MolecularWeight: 474.505223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CO4

InChI

InChI=1S/C22H23FN4O5S/c23-17-3-5-18(6-4-17)25-11-13-26(14-12-25)21(22-2-1-15-32-22)16-24-33(30,31)20-9-7-19(8-10-20)27(28)29/h1-10,15,21,24H,11-14,16H2