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

Systemtic Name: ethyl 4-[3,5-bis(fluoranyl)phenyl]-5-cyano-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylate Openeye Name: ethyl 5-cyano-4-(3,5-difluorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylate CAS Name: 5-cyano-4-(3,5-difluorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-(3,5-difluorophenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylate Traditional Name: 5-cyano-4-(3,5-difluorophenyl)-2-keto-6-methyl-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester Formula: C15H13F2N3O3 MolecularWeight: 321.278826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13F2N3O3/c1-3-23-15(22)20-13(9-4-10(16)6-11(17)5-9)12(7-18)8(2)19-14(20)21/h4-6,13H,3H2,1-2H3,(H,19,21)