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

Systemtic Name: N-butyl-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-butyl-6-[(4-methyl-1-piperidyl)sulfonyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-butyl-6-[(4-methyl-1-piperidinyl)sulfonyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-butyl-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-butyl-6-(4-methylpiperidino)sulfonyl-2-(3-pyridyl)cinchoninamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCC(CC3)C)C4=CN=CC=C4

Isomeric SMILES

CCCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCC(CC3)C)C4=CN=CC=C4

InChI

InChI=1S/C25H30N4O3S/c1-3-4-12-27-25(30)22-16-24(19-6-5-11-26-17-19)28-23-8-7-20(15-21(22)23)33(31,32)29-13-9-18(2)10-14-29/h5-8,11,15-18H,3-4,9-10,12-14H2,1-2H3,(H,27,30)