2-[[6-fluoranyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]methylamino]pyridine-3-carbonitrile

Systemtic Name: 2-[[6-fluoranyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]methylamino]pyridine-3-carbonitrile Openeye Name: 2-[[6-fluoro-3-(o-tolyl)-4-oxo-quinazolin-2-yl]methylamino]pyridine-3-carbonitrile CAS Name: 2-[[6-fluoro-3-(2-methylphenyl)-4-oxo-2-quinazolinyl]methylamino]-3-pyridinecarbonitrile IUPAC Name: 2-[[6-fluoro-3-(2-methylphenyl)-4-oxoquinazolin-2-yl]methylamino]pyridine-3-carbonitrile Traditional Name: 2-[[6-fluoro-4-keto-3-(o-tolyl)quinazolin-2-yl]methylamino]nicotinonitrile Formula: C22H16FN5O MolecularWeight: 385.393743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)F)CNC4=C(C=CC=N4)C#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)F)CNC4=C(C=CC=N4)C#N

InChI

InChI=1S/C22H16FN5O/c1-14-5-2-3-7-19(14)28-20(13-26-21-15(12-24)6-4-10-25-21)27-18-9-8-16(23)11-17(18)22(28)29/h2-11H,13H2,1H3,(H,25,26)