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

Systemtic Name: N-[bis(azanyl)methylidene]-2-(2-hexan-2-ylphenyl)quinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-[2-(1-methylpentyl)phenyl]quinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-(2-hexan-2-ylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-(2-hexan-2-ylphenyl)quinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-2-[2-(1-methylpentyl)phenyl]cinchoninamide Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N

Isomeric SMILES

CCCCC(C)C1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N

InChI

InChI=1S/C23H26N4O/c1-3-4-9-15(2)16-10-5-6-11-17(16)21-14-19(22(28)27-23(24)25)18-12-7-8-13-20(18)26-21/h5-8,10-15H,3-4,9H2,1-2H3,(H4,24,25,27,28)