N-(2-cyanoethyl)-4-pentyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-pentyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-(2-cyanoethyl)-4-pentyl-benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-pentyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-(2-cyanoethyl)-4-pentylbenzenesulfonamide Traditional Name: 4-amyl-N-benzyl-N-(2-cyanoethyl)benzenesulfonamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O2S/c1-2-3-5-9-19-12-14-21(15-13-19)26(24,25)23(17-8-16-22)18-20-10-6-4-7-11-20/h4,6-7,10-15H,2-3,5,8-9,17-18H2,1H3