N-[azanyl(phenylazanyl)methylidene]-3-(4-methylpentyl)quinoline-4-carboxamide

Systemtic Name: N-[azanyl(phenylazanyl)methylidene]-3-(4-methylpentyl)quinoline-4-carboxamide Openeye Name: N-[amino(anilino)methylene]-3-isohexyl-quinoline-4-carboxamide CAS Name: N-[amino(anilino)methylidene]-3-(4-methylpentyl)-4-quinolinecarboxamide IUPAC Name: N-[amino(anilino)methylidene]-3-(4-methylpentyl)quinoline-4-carboxamide Traditional Name: N-[amino(anilino)methylene]-3-isohexyl-cinchoninamide Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC1=C(C2=CC=CC=C2N=C1)C(=O)N=C(N)NC3=CC=CC=C3

Isomeric SMILES

CC(C)CCCC1=C(C2=CC=CC=C2N=C1)C(=O)N=C(N)NC3=CC=CC=C3

InChI

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