N-(2-cyanoethyl)-4-(2-methylbutan-2-yl)-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-(2-methylbutan-2-yl)-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-(2-cyanoethyl)-4-(1,1-dimethylpropyl)benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-(2-methylbutan-2-yl)-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-(2-cyanoethyl)-4-(2-methylbutan-2-yl)benzenesulfonamide Traditional Name: 4-tert-amyl-N-benzyl-N-(2-cyanoethyl)benzenesulfonamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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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=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O2S/c1-4-21(2,3)19-11-13-20(14-12-19)26(24,25)23(16-8-15-22)17-18-9-6-5-7-10-18/h5-7,9-14H,4,8,16-17H2,1-3H3