N-[2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N,4-dimethyl-benzenesulfonamide Openeye Name: N-[2-[4-(4-cyano-2-pyridyl)piperazin-1-yl]-2-oxo-ethyl]-N,4-dimethyl-benzenesulfonamide CAS Name: N-[2-[4-(4-cyano-2-pyridinyl)-1-piperazinyl]-2-oxoethyl]-N,4-dimethylbenzenesulfonamide IUPAC Name: N-[2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]-2-oxoethyl]-N,4-dimethylbenzenesulfonamide Traditional Name: N-[2-[4-(4-cyano-2-pyridyl)piperazino]-2-keto-ethyl]-N,4-dimethyl-benzenesulfonamide Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)N2CCN(CC2)C3=NC=CC(=C3)C#N

InChI

InChI=1S/C20H23N5O3S/c1-16-3-5-18(6-4-16)29(27,28)23(2)15-20(26)25-11-9-24(10-12-25)19-13-17(14-21)7-8-22-19/h3-8,13H,9-12,15H2,1-2H3