N-(2-cyanoethyl)-4-(2-methylbutan-2-yl)-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-(2-methylbutan-2-yl)-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-4-(1,1-dimethylpropyl)-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-(2-methylbutan-2-yl)-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-4-(2-methylbutan-2-yl)-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 4-tert-amyl-N-(2-cyanoethyl)-N-(3-pyridylmethyl)benzenesulfonamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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