N-[(2R)-2-(dimethylamino)-3-methyl-butyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[(2R)-2-(dimethylamino)-3-methyl-butyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[(2R)-2-(dimethylamino)-3-methyl-butyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[(2R)-2-(dimethylamino)-3-methylbutyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[(2R)-2-(dimethylamino)-3-methylbutyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[(2R)-2-(dimethylamino)-3-methyl-butyl]-2-(3-pyridyl)cinchoninamide Formula: C22H26N4O MolecularWeight: 362.46804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3)N(C)C

Isomeric SMILES

CC(C)[C@H](CNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CN=CC=C3)N(C)C

InChI

InChI=1S/C22H26N4O/c1-15(2)21(26(3)4)14-24-22(27)18-12-20(16-8-7-11-23-13-16)25-19-10-6-5-9-17(18)19/h5-13,15,21H,14H2,1-4H3,(H,24,27)/t21-/m0/s1