N-[4-fluoranyl-2-[(4-methylphenyl)amino]-5-oxidanylidene-3H-quinazolin-7-yl]-3-morpholin-4-yl-propanamide

Systemtic Name: N-[4-fluoranyl-2-[(4-methylphenyl)amino]-5-oxidanylidene-3H-quinazolin-7-yl]-3-morpholin-4-yl-propanamide Openeye Name: N-[4-fluoro-2-(4-methylanilino)-5-oxo-3H-quinazolin-7-yl]-3-morpholino-propanamide CAS Name: N-[4-fluoro-2-(4-methylanilino)-5-oxo-3H-quinazolin-7-yl]-3-(4-morpholinyl)propanamide IUPAC Name: N-[4-fluoro-2-(4-methylanilino)-5-oxo-3H-quinazolin-7-yl]-3-morpholin-4-ylpropanamide Traditional Name: N-[4-fluoro-5-keto-2-(p-toluidino)-3H-quinazolin-7-yl]-3-morpholino-propionamide Formula: C22H24FN5O3 MolecularWeight: 425.456063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC3=CC(=CC(=O)C3=C(N2)F)NC(=O)CCN4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC3=CC(=CC(=O)C3=C(N2)F)NC(=O)CCN4CCOCC4

InChI

InChI=1S/C22H24FN5O3/c1-14-2-4-15(5-3-14)25-22-26-17-12-16(13-18(29)20(17)21(23)27-22)24-19(30)6-7-28-8-10-31-11-9-28/h2-5,12-13H,6-11H2,1H3,(H,24,30)(H2,25,26,27)