N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[(4-morpholinosulfonylphenyl)methyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-(4-morpholinosulfonylbenzyl)-2-(4-pyridyl)cinchoninamide Formula: C26H24N4O4S MolecularWeight: 488.55816

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)CNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

InChI

InChI=1S/C26H24N4O4S/c31-26(23-17-25(20-9-11-27-12-10-20)29-24-4-2-1-3-22(23)24)28-18-19-5-7-21(8-6-19)35(32,33)30-13-15-34-16-14-30/h1-12,17H,13-16,18H2,(H,28,31)