N-(3-methylbutyl)-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-methylbutyl)-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-isopentyl-6-[(4-methyl-1-piperidyl)sulfonyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-(3-methylbutyl)-6-[(4-methyl-1-piperidinyl)sulfonyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(3-methylbutyl)-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-isoamyl-6-(4-methylpiperidino)sulfonyl-2-(2-pyridyl)cinchoninamide Formula: C26H32N4O3S MolecularWeight: 480.62228

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCCC(C)C)C4=CC=CC=N4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)NCCC(C)C)C4=CC=CC=N4

InChI

InChI=1S/C26H32N4O3S/c1-18(2)9-13-28-26(31)22-17-25(24-6-4-5-12-27-24)29-23-8-7-20(16-21(22)23)34(32,33)30-14-10-19(3)11-15-30/h4-8,12,16-19H,9-11,13-15H2,1-3H3,(H,28,31)