N-(2-cyanoethyl)-4-pentyl-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-pentyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-4-pentyl-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-pentyl-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-4-pentyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 4-amyl-N-(2-cyanoethyl)-N-(3-pyridylmethyl)benzenesulfonamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C20H25N3O2S/c1-2-3-4-7-18-9-11-20(12-10-18)26(24,25)23(15-6-13-21)17-19-8-5-14-22-16-19/h5,8-12,14,16H,2-4,6-7,15,17H2,1H3