3-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]carbonyl-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]carbonyl-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[4-(4-cyano-2-pyridyl)piperazine-1-carbonyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[4-(4-cyano-2-pyridinyl)-1-piperazinyl]-oxomethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[4-(4-cyanopyridin-2-yl)piperazine-1-carbonyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[4-(4-cyano-2-pyridyl)piperazine-1-carbonyl]-N,N-dimethyl-benzenesulfonamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O3S/c1-22(2)28(26,27)17-5-3-4-16(13-17)19(25)24-10-8-23(9-11-24)18-12-15(14-20)6-7-21-18/h3-7,12-13H,8-11H2,1-2H3