2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide

Systemtic Name: 2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide Openeye Name: 2-[4-(4-cyano-2-pyridyl)piperazin-1-yl]-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide CAS Name: 2-[4-(4-cyano-2-pyridinyl)-1-piperazinyl]-N-(2-methoxyphenyl)-5-nitrobenzenesulfonamide IUPAC Name: 2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]-N-(2-methoxyphenyl)-5-nitrobenzenesulfonamide Traditional Name: 2-[4-(4-cyano-2-pyridyl)piperazino]-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide Formula: C23H22N6O5S MolecularWeight: 494.52298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCN(CC3)C4=NC=CC(=C4)C#N

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCN(CC3)C4=NC=CC(=C4)C#N

InChI

InChI=1S/C23H22N6O5S/c1-34-21-5-3-2-4-19(21)26-35(32,33)22-15-18(29(30)31)6-7-20(22)27-10-12-28(13-11-27)23-14-17(16-24)8-9-25-23/h2-9,14-15,26H,10-13H2,1H3