2-cyano-N-[[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 2-cyano-N-[[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]methyl]benzenesulfonamide Openeye Name: 2-cyano-N-[[4-[4-(4-pyridyl)piperazin-1-yl]phenyl]methyl]benzenesulfonamide CAS Name: 2-cyano-N-[[4-(4-pyridin-4-yl-1-piperazinyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 2-cyano-N-[[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]methyl]benzenesulfonamide Traditional Name: 2-cyano-N-[4-[4-(4-pyridyl)piperazino]benzyl]benzenesulfonamide Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC=C3C#N)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)CNS(=O)(=O)C3=CC=CC=C3C#N)C4=CC=NC=C4

InChI

InChI=1S/C23H23N5O2S/c24-17-20-3-1-2-4-23(20)31(29,30)26-18-19-5-7-21(8-6-19)27-13-15-28(16-14-27)22-9-11-25-12-10-22/h1-12,26H,13-16,18H2