N-(4-cyano-3-naphthalen-1-yl-phenyl)-N-[(3-methylimidazol-4-yl)methyl]benzenesulfonamide

Systemtic Name: N-(4-cyano-3-naphthalen-1-yl-phenyl)-N-[(3-methylimidazol-4-yl)methyl]benzenesulfonamide Openeye Name: N-[4-cyano-3-(1-naphthyl)phenyl]-N-[(3-methylimidazol-4-yl)methyl]benzenesulfonamide CAS Name: N-[4-cyano-3-(1-naphthalenyl)phenyl]-N-[(3-methyl-4-imidazolyl)methyl]benzenesulfonamide IUPAC Name: N-(4-cyano-3-naphthalen-1-ylphenyl)-N-[(3-methylimidazol-4-yl)methyl]benzenesulfonamide Traditional Name: N-[4-cyano-3-(1-naphthyl)phenyl]-N-[(3-methylimidazol-4-yl)methyl]benzenesulfonamide Formula: C28H22N4O2S MolecularWeight: 478.56488

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CN(C2=CC(=C(C=C2)C#N)C3=CC=CC4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CN1C=NC=C1CN(C2=CC(=C(C=C2)C#N)C3=CC=CC4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H22N4O2S/c1-31-20-30-18-24(31)19-32(35(33,34)25-10-3-2-4-11-25)23-15-14-22(17-29)28(16-23)27-13-7-9-21-8-5-6-12-26(21)27/h2-16,18,20H,19H2,1H3