6-(azepan-1-ylsulfonyl)-N-(2-methoxyethyl)-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-N-(2-methoxyethyl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-N-(2-methoxyethyl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-N-(2-methoxyethyl)-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-N-(2-methoxyethyl)-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-N-(2-methoxyethyl)-2-(3-pyridyl)cinchoninamide Formula: C24H28N4O4S MolecularWeight: 468.56852

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C4=CN=CC=C4

Isomeric SMILES

COCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCCCCC3)C4=CN=CC=C4

InChI

InChI=1S/C24H28N4O4S/c1-32-14-11-26-24(29)21-16-23(18-7-6-10-25-17-18)27-22-9-8-19(15-20(21)22)33(30,31)28-12-4-2-3-5-13-28/h6-10,15-17H,2-5,11-14H2,1H3,(H,26,29)