N-[bis(azanyl)methylidene]-2-[3-(3,3-dimethylbutan-2-yl)phenyl]quinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-[3-(3,3-dimethylbutan-2-yl)phenyl]quinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-[3-(1,2,2-trimethylpropyl)phenyl]quinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-[3-(3,3-dimethylbutan-2-yl)phenyl]-4-quinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-[3-(3,3-dimethylbutan-2-yl)phenyl]quinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-2-[3-(1,2,2-trimethylpropyl)phenyl]cinchoninamide Formula: C23H26N4O MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N)C(C)(C)C

Isomeric SMILES

CC(C1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N)C(C)(C)C

InChI

InChI=1S/C23H26N4O/c1-14(23(2,3)4)15-8-7-9-16(12-15)20-13-18(21(28)27-22(24)25)17-10-5-6-11-19(17)26-20/h5-14H,1-4H3,(H4,24,25,27,28)