N-[bis(azanyl)methylidene]-2-(2-pentylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-(2-pentylphenyl)quinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-(2-pentylphenyl)quinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-(2-pentylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-(2-pentylphenyl)quinoline-4-carboxamide Traditional Name: 2-(2-amylphenyl)-N-(diaminomethylene)cinchoninamide Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N

Isomeric SMILES

CCCCCC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N

InChI

InChI=1S/C22H24N4O/c1-2-3-4-9-15-10-5-6-11-16(15)20-14-18(21(27)26-22(23)24)17-12-7-8-13-19(17)25-20/h5-8,10-14H,2-4,9H2,1H3,(H4,23,24,26,27)