4-[(6-azanyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(6-azanyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(6-amino-4-oxo-1H-quinazolin-2-yl)methyl]benzonitrile CAS Name: 4-[(6-amino-4-oxo-1H-quinazolin-2-yl)methyl]benzonitrile IUPAC Name: 4-[(6-amino-4-oxo-1H-quinazolin-2-yl)methyl]benzonitrile Traditional Name: 4-[(6-amino-4-keto-1H-quinazolin-2-yl)methyl]benzonitrile Formula: C16H12N4O MolecularWeight: 276.29268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=NC(=O)C3=C(N2)C=CC(=C3)N)C#N

Isomeric SMILES

C1=CC(=CC=C1CC2=NC(=O)C3=C(N2)C=CC(=C3)N)C#N

InChI

InChI=1S/C16H12N4O/c17-9-11-3-1-10(2-4-11)7-15-19-14-6-5-12(18)8-13(14)16(21)20-15/h1-6,8H,7,18H2,(H,19,20,21)