N-butan-2-yl-2-[(2,5-dimethylphenyl)amino]quinoline-4-carboxamide

Systemtic Name: N-butan-2-yl-2-[(2,5-dimethylphenyl)amino]quinoline-4-carboxamide Openeye Name: 2-(2,5-dimethylanilino)-N-sec-butyl-quinoline-4-carboxamide CAS Name: N-butan-2-yl-2-(2,5-dimethylanilino)-4-quinolinecarboxamide IUPAC Name: N-butan-2-yl-2-(2,5-dimethylanilino)quinoline-4-carboxamide Traditional Name: 2-(2,5-dimethylanilino)-N-sec-butyl-cinchoninamide Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)NC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCC(C)NC(=O)C1=CC(=NC2=CC=CC=C21)NC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H25N3O/c1-5-16(4)23-22(26)18-13-21(24-19-9-7-6-8-17(18)19)25-20-12-14(2)10-11-15(20)3/h6-13,16H,5H2,1-4H3,(H,23,26)(H,24,25)