N-[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methyl-phenyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[4-[(3-cyano-2-pyridinyl)oxy]-2-methylphenyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[4-(3-cyanopyridin-2-yl)oxy-2-methylphenyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[4-[(3-cyano-2-pyridyl)oxy]-2-methyl-phenyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C25H21N5O3 MolecularWeight: 439.46594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C=CC=N2)C#N)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C=CC=N2)C#N)NC(=O)CCCN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C25H21N5O3/c1-17-14-19(33-24-18(15-26)6-4-12-27-24)10-11-21(17)29-23(31)9-5-13-30-16-28-22-8-3-2-7-20(22)25(30)32/h2-4,6-8,10-12,14,16H,5,9,13H2,1H3,(H,29,31)