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

Systemtic Name: N-[3-[4-(3-cyanopyridin-2-yl)piperazin-1-yl]quinoxalin-2-yl]-2-methyl-benzenesulfonamide Openeye Name: N-[3-[4-(3-cyano-2-pyridyl)piperazin-1-yl]quinoxalin-2-yl]-2-methyl-benzenesulfonamide CAS Name: N-[3-[4-(3-cyano-2-pyridinyl)-1-piperazinyl]-2-quinoxalinyl]-2-methylbenzenesulfonamide IUPAC Name: N-[3-[4-(3-cyanopyridin-2-yl)piperazin-1-yl]quinoxalin-2-yl]-2-methylbenzenesulfonamide Traditional Name: N-[3-[4-(3-cyano-2-pyridyl)piperazino]quinoxalin-2-yl]-2-methyl-benzenesulfonamide Formula: C25H23N7O2S MolecularWeight: 485.56082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC2=NC3=CC=CC=C3N=C2N4CCN(CC4)C5=C(C=CC=N5)C#N

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC2=NC3=CC=CC=C3N=C2N4CCN(CC4)C5=C(C=CC=N5)C#N

InChI

InChI=1S/C25H23N7O2S/c1-18-7-2-5-11-22(18)35(33,34)30-23-25(29-21-10-4-3-9-20(21)28-23)32-15-13-31(14-16-32)24-19(17-26)8-6-12-27-24/h2-12H,13-16H2,1H3,(H,28,30)