4-[(6-azanyl-4-oxidanylidene-quinazolin-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(6-azanyl-4-oxidanylidene-quinazolin-3-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(6-amino-4-oxo-quinazolin-3-yl)methyl]benzonitrile CAS Name: 4-[(6-amino-4-oxo-3-quinazolinyl)methyl]benzonitrile IUPAC Name: 4-[(6-amino-4-oxoquinazolin-3-yl)methyl]benzonitrile Traditional Name: 4-[(6-amino-4-keto-quinazolin-3-yl)methyl]benzonitrile Formula: C16H12N4O MolecularWeight: 276.29268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=C(C=C3)N)C#N

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=C(C=C3)N)C#N

InChI

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