ethyl 4-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoate

Systemtic Name: ethyl 4-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]amino]benzoate Openeye Name: ethyl 4-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoate CAS Name: 4-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-[(4-fluorophenyl)methyl]-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoate Traditional Name: 4-[[5-(4-fluorobenzyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]amino]benzoic acid ethyl ester Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=O)C(=C(N2)C)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=O)C(=C(N2)C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O3/c1-3-28-20(27)15-6-10-17(11-7-15)24-21-23-13(2)18(19(26)25-21)12-14-4-8-16(22)9-5-14/h4-11H,3,12H2,1-2H3,(H2,23,24,25,26)