N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-(2-methyl-5-piperidinosulfonyl-phenyl)-2-(2-pyridyl)cinchoninamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

InChI

InChI=1S/C27H26N4O3S/c1-19-12-13-20(35(33,34)31-15-7-2-8-16-31)17-25(19)30-27(32)22-18-26(24-11-5-6-14-28-24)29-23-10-4-3-9-21(22)23/h3-6,9-14,17-18H,2,7-8,15-16H2,1H3,(H,30,32)