3-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]carbonyl-N-ethyl-4-methyl-benzenesulfonamide

Systemtic Name: 3-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]carbonyl-N-ethyl-4-methyl-benzenesulfonamide Openeye Name: 3-[4-(4-cyano-2-pyridyl)piperazine-1-carbonyl]-N-ethyl-4-methyl-benzenesulfonamide CAS Name: 3-[[4-(4-cyano-2-pyridinyl)-1-piperazinyl]-oxomethyl]-N-ethyl-4-methylbenzenesulfonamide IUPAC Name: 3-[4-(4-cyanopyridin-2-yl)piperazine-1-carbonyl]-N-ethyl-4-methylbenzenesulfonamide Traditional Name: 3-[4-(4-cyano-2-pyridyl)piperazine-1-carbonyl]-N-ethyl-4-methyl-benzenesulfonamide Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O3S/c1-3-23-29(27,28)17-5-4-15(2)18(13-17)20(26)25-10-8-24(9-11-25)19-12-16(14-21)6-7-22-19/h4-7,12-13,23H,3,8-11H2,1-2H3