[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-[(4-fluorophenyl)carbonylamino]ethanoate

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 2-[(4-fluorophenyl)carbonylamino]ethanoate Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl 2-[(4-fluorobenzoyl)amino]acetate CAS Name: 2-[[(4-fluorophenyl)-oxomethyl]amino]acetic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl 2-[(4-fluorobenzoyl)amino]acetate Traditional Name: 2-[(4-fluorobenzoyl)amino]acetic acid [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C20H15FN4O4 MolecularWeight: 394.355903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)COC(=O)CNC(=O)C3=CC=C(C=C3)F)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)COC(=O)CNC(=O)C3=CC=C(C=C3)F)CC#N

InChI

InChI=1S/C20H15FN4O4/c21-14-7-5-13(6-8-14)19(27)23-11-18(26)29-12-17-24-16-4-2-1-3-15(16)20(28)25(17)10-9-22/h1-8H,10-12H2,(H,23,27)