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

Systemtic Name: N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-(2-methoxy-5-piperidinosulfonyl-phenyl)-2-(4-pyridyl)cinchoninamide Formula: C27H26N4O4S MolecularWeight: 502.58474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

InChI

InChI=1S/C27H26N4O4S/c1-35-26-10-9-20(36(33,34)31-15-5-2-6-16-31)17-25(26)30-27(32)22-18-24(19-11-13-28-14-12-19)29-23-8-4-3-7-21(22)23/h3-4,7-14,17-18H,2,5-6,15-16H2,1H3,(H,30,32)