N-[(2-chlorophenyl)methyl]-2-[(2,4-dimethylphenyl)amino]quinoline-4-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-2-[(2,4-dimethylphenyl)amino]quinoline-4-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-2-(2,4-dimethylanilino)quinoline-4-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-2-(2,4-dimethylanilino)-4-quinolinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-2-(2,4-dimethylanilino)quinoline-4-carboxamide Traditional Name: N-(2-chlorobenzyl)-2-(2,4-dimethylanilino)cinchoninamide Formula: C25H22ClN3O MolecularWeight: 415.91468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=CC=C4Cl)C

InChI

InChI=1S/C25H22ClN3O/c1-16-11-12-22(17(2)13-16)28-24-14-20(19-8-4-6-10-23(19)29-24)25(30)27-15-18-7-3-5-9-21(18)26/h3-14H,15H2,1-2H3,(H,27,30)(H,28,29)