methyl 2-[4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]carbamoyl]quinazolin-3-yl]benzoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]carbamoyl]quinazolin-3-yl]benzoate Openeye Name: methyl 2-[4-oxo-2-[[3-(trifluoromethyl)phenyl]carbamoyl]quinazolin-3-yl]benzoate CAS Name: 2-[4-oxo-2-[oxo-[3-(trifluoromethyl)anilino]methyl]-3-quinazolinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[[3-(trifluoromethyl)phenyl]carbamoyl]quinazolin-3-yl]benzoate Traditional Name: 2-[4-keto-2-[[3-(trifluoromethyl)phenyl]carbamoyl]quinazolin-3-yl]benzoic acid methyl ester Formula: C24H16F3N3O4 MolecularWeight: 467.39675

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2C(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2C(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H16F3N3O4/c1-34-23(33)17-10-3-5-12-19(17)30-20(29-18-11-4-2-9-16(18)22(30)32)21(31)28-15-8-6-7-14(13-15)24(25,26)27/h2-13H,1H3,(H,28,31)