3-cyano-N-[(4-ethylphenyl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: 3-cyano-N-[(4-ethylphenyl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: 3-cyano-N-[(4-ethylphenyl)methyl]-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: 3-cyano-N-[(4-ethylphenyl)methyl]-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: 3-cyano-N-[(4-ethylphenyl)methyl]-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 3-cyano-N-(4-ethylbenzyl)-N-(3-pyridylmethyl)benzenesulfonamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H21N3O2S/c1-2-18-8-10-19(11-9-18)16-25(17-21-6-4-12-24-15-21)28(26,27)22-7-3-5-20(13-22)14-23/h3-13,15H,2,16-17H2,1H3