2-azanyl-6-fluoranyl-3-(2-methylphenyl)-4-oxidanylidene-5-(quinazolin-2-ylmethyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-fluoranyl-3-(2-methylphenyl)-4-oxidanylidene-5-(quinazolin-2-ylmethyl)pyridine-3-carbonitrile Openeye Name: 2-amino-6-fluoro-3-(o-tolyl)-4-oxo-5-(quinazolin-2-ylmethyl)pyridine-3-carbonitrile CAS Name: 2-amino-6-fluoro-3-(2-methylphenyl)-4-oxo-5-(2-quinazolinylmethyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-fluoro-3-(2-methylphenyl)-4-oxo-5-(quinazolin-2-ylmethyl)pyridine-3-carbonitrile Traditional Name: 2-amino-6-fluoro-4-keto-3-(o-tolyl)-5-(quinazolin-2-ylmethyl)nicotinonitrile Formula: C22H16FN5O MolecularWeight: 385.393743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2(C(=O)C(=C(N=C2N)F)CC3=NC4=CC=CC=C4C=N3)C#N

Isomeric SMILES

CC1=CC=CC=C1C2(C(=O)C(=C(N=C2N)F)CC3=NC4=CC=CC=C4C=N3)C#N

InChI

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