2-methyl-N-[3-(4-piperidin-1-ylcarbonylpiperazin-1-yl)quinoxalin-2-yl]benzenesulfonamide

Systemtic Name: 2-methyl-N-[3-(4-piperidin-1-ylcarbonylpiperazin-1-yl)quinoxalin-2-yl]benzenesulfonamide Openeye Name: 2-methyl-N-[3-[4-(piperidine-1-carbonyl)piperazin-1-yl]quinoxalin-2-yl]benzenesulfonamide CAS Name: 2-methyl-N-[3-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]-2-quinoxalinyl]benzenesulfonamide IUPAC Name: 2-methyl-N-[3-[4-(piperidine-1-carbonyl)piperazin-1-yl]quinoxalin-2-yl]benzenesulfonamide Traditional Name: 2-methyl-N-[3-[4-(piperidine-1-carbonyl)piperazino]quinoxalin-2-yl]benzenesulfonamide Formula: C25H30N6O3S MolecularWeight: 494.6091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC2=NC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)N5CCCCC5

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC2=NC3=CC=CC=C3N=C2N4CCN(CC4)C(=O)N5CCCCC5

InChI

InChI=1S/C25H30N6O3S/c1-19-9-3-6-12-22(19)35(33,34)28-23-24(27-21-11-5-4-10-20(21)26-23)29-15-17-31(18-16-29)25(32)30-13-7-2-8-14-30/h3-6,9-12H,2,7-8,13-18H2,1H3,(H,26,28)