N-[azanyl(phenylazanyl)methylidene]-5-(3-methylbutan-2-yl)quinoline-4-carboxamide

Systemtic Name: N-[azanyl(phenylazanyl)methylidene]-5-(3-methylbutan-2-yl)quinoline-4-carboxamide Openeye Name: N-[amino(anilino)methylene]-5-(1,2-dimethylpropyl)quinoline-4-carboxamide CAS Name: N-[amino(anilino)methylidene]-5-(3-methylbutan-2-yl)-4-quinolinecarboxamide IUPAC Name: N-[amino(anilino)methylidene]-5-(3-methylbutan-2-yl)quinoline-4-carboxamide Traditional Name: N-[amino(anilino)methylene]-5-(1,2-dimethylpropyl)cinchoninamide Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)C1=C2C(=CC=NC2=CC=C1)C(=O)N=C(N)NC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C)C1=C2C(=CC=NC2=CC=C1)C(=O)N=C(N)NC3=CC=CC=C3

InChI

InChI=1S/C22H24N4O/c1-14(2)15(3)17-10-7-11-19-20(17)18(12-13-24-19)21(27)26-22(23)25-16-8-5-4-6-9-16/h4-15H,1-3H3,(H3,23,25,26,27)