N-[2-[butyl(methyl)amino]ethyl]-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-[butyl(methyl)amino]ethyl]-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-[butyl(methyl)amino]ethyl]-6-[(4-methyl-1-piperidyl)sulfonyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-[butyl(methyl)amino]ethyl]-6-[(4-methyl-1-piperidinyl)sulfonyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[2-[butyl(methyl)amino]ethyl]-6-(4-methylpiperidin-1-yl)sulfonyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-[2-[butyl(methyl)amino]ethyl]-6-(4-methylpiperidino)sulfonyl-2-(2-pyridyl)cinchoninamide Formula: C28H37N5O3S MolecularWeight: 523.69008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)CCNC(=O)C1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCC(CC3)C)C4=CC=CC=N4

Isomeric SMILES

CCCCN(C)CCNC(=O)C1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCC(CC3)C)C4=CC=CC=N4

InChI

InChI=1S/C28H37N5O3S/c1-4-5-15-32(3)18-14-30-28(34)24-20-27(26-8-6-7-13-29-26)31-25-10-9-22(19-23(24)25)37(35,36)33-16-11-21(2)12-17-33/h6-10,13,19-21H,4-5,11-12,14-18H2,1-3H3,(H,30,34)