N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[(4-morpholinosulfonylphenyl)methyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(4-morpholinosulfonylbenzyl)-2-(3-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=CN=CC=C5

Isomeric SMILES

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

InChI

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