2-[(2,5-dimethylphenyl)amino]-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-[(2,5-dimethylphenyl)amino]-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-(2,5-dimethylanilino)-N-(3-pyridylmethyl)quinoline-4-carboxamide CAS Name: 2-(2,5-dimethylanilino)-N-(3-pyridinylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-(2,5-dimethylanilino)-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-(2,5-dimethylanilino)-N-(3-pyridylmethyl)cinchoninamide Formula: C24H22N4O MolecularWeight: 382.45768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C24H22N4O/c1-16-9-10-17(2)22(12-16)28-23-13-20(19-7-3-4-8-21(19)27-23)24(29)26-15-18-6-5-11-25-14-18/h3-14H,15H2,1-2H3,(H,26,29)(H,27,28)