N-[bis(azanyl)methylidene]-6-(5-butoxypentoxy)-2-(2-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-6-(5-butoxypentoxy)-2-(2-methylphenyl)quinoline-4-carboxamide Openeye Name: 6-(5-butoxypentoxy)-N-(diaminomethylene)-2-(o-tolyl)quinoline-4-carboxamide CAS Name: 6-(5-butoxypentoxy)-N-(diaminomethylidene)-2-(2-methylphenyl)-4-quinolinecarboxamide IUPAC Name: 6-(5-butoxypentoxy)-N-(diaminomethylidene)-2-(2-methylphenyl)quinoline-4-carboxamide Traditional Name: 6-(5-butoxypentoxy)-N-(diaminomethylene)-2-(o-tolyl)cinchoninamide Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCCCOC1=CC2=C(C=C1)N=C(C=C2C(=O)N=C(N)N)C3=CC=CC=C3C

Isomeric SMILES

CCCCOCCCCCOC1=CC2=C(C=C1)N=C(C=C2C(=O)N=C(N)N)C3=CC=CC=C3C

InChI

InChI=1S/C27H34N4O3/c1-3-4-14-33-15-8-5-9-16-34-20-12-13-24-22(17-20)23(26(32)31-27(28)29)18-25(30-24)21-11-7-6-10-19(21)2/h6-7,10-13,17-18H,3-5,8-9,14-16H2,1-2H3,(H4,28,29,31,32)