N-[bis(azanyl)methylidene]-7-(2,2-dimethylpropoxy)-2-(2-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-7-(2,2-dimethylpropoxy)-2-(2-methylphenyl)quinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-7-(2,2-dimethylpropoxy)-2-(o-tolyl)quinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-7-(2,2-dimethylpropoxy)-2-(2-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-7-(2,2-dimethylpropoxy)-2-(2-methylphenyl)quinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-7-neopentyloxy-2-(o-tolyl)cinchoninamide Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC3=C(C=CC(=C3)OCC(C)(C)C)C(=C2)C(=O)N=C(N)N

Isomeric SMILES

CC1=CC=CC=C1C2=NC3=C(C=CC(=C3)OCC(C)(C)C)C(=C2)C(=O)N=C(N)N

InChI

InChI=1S/C23H26N4O2/c1-14-7-5-6-8-16(14)20-12-18(21(28)27-22(24)25)17-10-9-15(11-19(17)26-20)29-13-23(2,3)4/h5-12H,13H2,1-4H3,(H4,24,25,27,28)