4-bromanyl-N-(2-cyanoethyl)-2-ethyl-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(2-cyanoethyl)-2-ethyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: 4-bromo-N-(2-cyanoethyl)-2-ethyl-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: 4-bromo-N-(2-cyanoethyl)-2-ethyl-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: 4-bromo-N-(2-cyanoethyl)-2-ethyl-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: 4-bromo-N-(2-cyanoethyl)-2-ethyl-N-(3-pyridylmethyl)benzenesulfonamide Formula: C17H18BrN3O2S MolecularWeight: 408.31272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18BrN3O2S/c1-2-15-11-16(18)6-7-17(15)24(22,23)21(10-4-8-19)13-14-5-3-9-20-12-14/h3,5-7,9,11-12H,2,4,10,13H2,1H3