ethyl 5-cyano-4-(3-cyano-4-fluoranyl-phenyl)-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylate

Systemtic Name: ethyl 5-cyano-4-(3-cyano-4-fluoranyl-phenyl)-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylate Openeye Name: ethyl 5-cyano-4-(3-cyano-4-fluoro-phenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylate CAS Name: 5-cyano-4-(3-cyano-4-fluorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-(3-cyano-4-fluorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylate Traditional Name: 5-cyano-4-(3-cyano-4-fluoro-phenyl)-2-keto-6-methyl-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester Formula: C16H13FN4O3 MolecularWeight: 328.297823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2=CC(=C(C=C2)F)C#N

Isomeric SMILES

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2=CC(=C(C=C2)F)C#N

InChI

InChI=1S/C16H13FN4O3/c1-3-24-16(23)21-14(12(8-19)9(2)20-15(21)22)10-4-5-13(17)11(6-10)7-18/h4-6,14H,3H2,1-2H3,(H,20,22)