4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methylamino]benzenecarbonitrile

Systemtic Name: 4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methylamino]benzenecarbonitrile Openeye Name: 4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]benzonitrile CAS Name: 4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]benzonitrile IUPAC Name: 4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]benzonitrile Traditional Name: 4-[(1-keto-3-methyl-4H-benzo[f]quinazolin-9-yl)methylamino]benzonitrile Formula: C21H16N4O MolecularWeight: 340.37794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1)C=CC3=C2C=C(C=C3)CNC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=NC(=O)C2=C(N1)C=CC3=C2C=C(C=C3)CNC4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H16N4O/c1-13-24-19-9-6-16-5-2-15(10-18(16)20(19)21(26)25-13)12-23-17-7-3-14(11-22)4-8-17/h2-10,23H,12H2,1H3,(H,24,25,26)