N-[azanyl(phenylazanyl)methylidene]-5-(4-methylpentyl)quinoline-4-carboxamide

Systemtic Name: N-[azanyl(phenylazanyl)methylidene]-5-(4-methylpentyl)quinoline-4-carboxamide Openeye Name: N-[amino(anilino)methylene]-5-isohexyl-quinoline-4-carboxamide CAS Name: N-[amino(anilino)methylidene]-5-(4-methylpentyl)-4-quinolinecarboxamide IUPAC Name: N-[amino(anilino)methylidene]-5-(4-methylpentyl)quinoline-4-carboxamide Traditional Name: N-[amino(anilino)methylene]-5-isohexyl-cinchoninamide Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC1=C2C(=CC=NC2=CC=C1)C(=O)N=C(N)NC3=CC=CC=C3

Isomeric SMILES

CC(C)CCCC1=C2C(=CC=NC2=CC=C1)C(=O)N=C(N)NC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O/c1-16(2)8-6-9-17-10-7-13-20-21(17)19(14-15-25-20)22(28)27-23(24)26-18-11-4-3-5-12-18/h3-5,7,10-16H,6,8-9H2,1-2H3,(H3,24,26,27,28)