N-[3-[ethyl-(3-methylphenyl)amino]propyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[3-[ethyl-(3-methylphenyl)amino]propyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[3-(N-ethyl-3-methylanilino)propyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[3-(N-ethyl-3-methylanilino)propyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-2-(4-pyridyl)cinchoninamide Formula: C27H28N4O MolecularWeight: 424.53742

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3)C4=CC=CC(=C4)C

Isomeric SMILES

CCN(CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=NC=C3)C4=CC=CC(=C4)C

InChI

InChI=1S/C27H28N4O/c1-3-31(22-9-6-8-20(2)18-22)17-7-14-29-27(32)24-19-26(21-12-15-28-16-13-21)30-25-11-5-4-10-23(24)25/h4-6,8-13,15-16,18-19H,3,7,14,17H2,1-2H3,(H,29,32)