N-[(4-ethoxyphenyl)methyl]-6-morpholin-4-ylsulfonyl-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[(4-ethoxyphenyl)methyl]-6-morpholin-4-ylsulfonyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[(4-ethoxyphenyl)methyl]-6-morpholinosulfonyl-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[(4-ethoxyphenyl)methyl]-6-(4-morpholinylsulfonyl)-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[(4-ethoxyphenyl)methyl]-6-morpholin-4-ylsulfonyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-(4-ethoxybenzyl)-6-morpholinosulfonyl-2-(2-pyridyl)cinchoninamide Formula: C28H28N4O5S MolecularWeight: 532.61072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=N5

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=N5

InChI

InChI=1S/C28H28N4O5S/c1-2-37-21-8-6-20(7-9-21)19-30-28(33)24-18-27(26-5-3-4-12-29-26)31-25-11-10-22(17-23(24)25)38(34,35)32-13-15-36-16-14-32/h3-12,17-18H,2,13-16,19H2,1H3,(H,30,33)