2-methyl-N-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]quinoline-8-sulfonamide

Systemtic Name: 2-methyl-N-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]quinoline-8-sulfonamide Openeye Name: 2-methyl-N-[4-[[4-(2-pyridyl)piperazin-1-yl]methyl]phenyl]quinoline-8-sulfonamide CAS Name: 2-methyl-N-[4-[[4-(2-pyridinyl)-1-piperazinyl]methyl]phenyl]-8-quinolinesulfonamide IUPAC Name: 2-methyl-N-[4-[(4-pyridin-2-ylpiperazin-1-yl)methyl]phenyl]quinoline-8-sulfonamide Traditional Name: 2-methyl-N-[4-[[4-(2-pyridyl)piperazino]methyl]phenyl]quinoline-8-sulfonamide Formula: C26H27N5O2S MolecularWeight: 473.58988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)CN4CCN(CC4)C5=CC=CC=N5)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2S(=O)(=O)NC3=CC=C(C=C3)CN4CCN(CC4)C5=CC=CC=N5)C=C1

InChI

InChI=1S/C26H27N5O2S/c1-20-8-11-22-5-4-6-24(26(22)28-20)34(32,33)29-23-12-9-21(10-13-23)19-30-15-17-31(18-16-30)25-7-2-3-14-27-25/h2-14,29H,15-19H2,1H3