2-[(2-chloranyl-5-fluoranyl-4-oxidanylidene-quinazolin-3-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(2-chloranyl-5-fluoranyl-4-oxidanylidene-quinazolin-3-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(2-chloro-5-fluoro-4-oxo-quinazolin-3-yl)methyl]benzonitrile CAS Name: 2-[(2-chloro-5-fluoro-4-oxo-3-quinazolinyl)methyl]benzonitrile IUPAC Name: 2-[(2-chloro-5-fluoro-4-oxoquinazolin-3-yl)methyl]benzonitrile Traditional Name: 2-[(2-chloro-5-fluoro-4-keto-quinazolin-3-yl)methyl]benzonitrile Formula: C16H9ClFN3O MolecularWeight: 313.713563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C3=C(C=CC=C3F)N=C2Cl)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C3=C(C=CC=C3F)N=C2Cl)C#N

InChI

InChI=1S/C16H9ClFN3O/c17-16-20-13-7-3-6-12(18)14(13)15(22)21(16)9-11-5-2-1-4-10(11)8-19/h1-7H,9H2