N-(2-cyanoethyl)-4-(2-oxidanylidenepyrrolidin-1-yl)-N-(pyridin-3-ylmethyl)benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-(2-oxidanylidenepyrrolidin-1-yl)-N-(pyridin-3-ylmethyl)benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-4-(2-oxopyrrolidin-1-yl)-N-(3-pyridylmethyl)benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-(2-oxo-1-pyrrolidinyl)-N-(3-pyridinylmethyl)benzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-4-(2-oxopyrrolidin-1-yl)-N-(pyridin-3-ylmethyl)benzenesulfonamide Traditional Name: N-(2-cyanoethyl)-4-(2-ketopyrrolidino)-N-(3-pyridylmethyl)benzenesulfonamide Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)CC3=CN=CC=C3

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)CC3=CN=CC=C3

InChI

InChI=1S/C19H20N4O3S/c20-10-3-12-22(15-16-4-1-11-21-14-16)27(25,26)18-8-6-17(7-9-18)23-13-2-5-19(23)24/h1,4,6-9,11,14H,2-3,5,12-13,15H2