N-[bis(azanyl)methylidene]-2-[2-(2-methylbutan-2-yloxy)phenyl]quinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-[2-(2-methylbutan-2-yloxy)phenyl]quinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-[2-(1,1-dimethylpropoxy)phenyl]quinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-[2-(2-methylbutan-2-yloxy)phenyl]-4-quinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-[2-(2-methylbutan-2-yloxy)phenyl]quinoline-4-carboxamide Traditional Name: 2-(2-tert-amyloxyphenyl)-N-(diaminomethylene)cinchoninamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)OC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N

Isomeric SMILES

CCC(C)(C)OC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N

InChI

InChI=1S/C22H24N4O2/c1-4-22(2,3)28-19-12-8-6-10-15(19)18-13-16(20(27)26-21(23)24)14-9-5-7-11-17(14)25-18/h5-13H,4H2,1-3H3,(H4,23,24,26,27)