N-(1-cyclohexylethyl)-2-phenyl-3-(pyridin-2-ylmethyl)quinoline-4-carboxamide

Systemtic Name: N-(1-cyclohexylethyl)-2-phenyl-3-(pyridin-2-ylmethyl)quinoline-4-carboxamide Openeye Name: N-(1-cyclohexylethyl)-2-phenyl-3-(2-pyridylmethyl)quinoline-4-carboxamide CAS Name: N-(1-cyclohexylethyl)-2-phenyl-3-(2-pyridinylmethyl)-4-quinolinecarboxamide IUPAC Name: N-(1-cyclohexylethyl)-2-phenyl-3-(pyridin-2-ylmethyl)quinoline-4-carboxamide Traditional Name: N-(1-cyclohexylethyl)-2-phenyl-3-(2-pyridylmethyl)cinchoninamide Formula: C30H31N3O MolecularWeight: 449.58664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=CC=N5

Isomeric SMILES

CC(C1CCCCC1)NC(=O)C2=C(C(=NC3=CC=CC=C32)C4=CC=CC=C4)CC5=CC=CC=N5

InChI

InChI=1S/C30H31N3O/c1-21(22-12-4-2-5-13-22)32-30(34)28-25-17-8-9-18-27(25)33-29(23-14-6-3-7-15-23)26(28)20-24-16-10-11-19-31-24/h3,6-11,14-19,21-22H,2,4-5,12-13,20H2,1H3,(H,32,34)