ethyl (6S)-3-ethyl-6-(4-fluorophenyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl (6S)-3-ethyl-6-(4-fluorophenyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-3-ethyl-6-(4-fluorophenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-ethyl-6-(4-fluorophenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-3-ethyl-6-(4-fluorophenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-ethyl-6-(4-fluorophenyl)-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C16H19FN2O3 MolecularWeight: 306.332063

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)F)C(=O)OCC)C

Isomeric SMILES

CCN1C(=C([C@@H](NC1=O)C2=CC=C(C=C2)F)C(=O)OCC)C

InChI

InChI=1S/C16H19FN2O3/c1-4-19-10(3)13(15(20)22-5-2)14(18-16(19)21)11-6-8-12(17)9-7-11/h6-9,14H,4-5H2,1-3H3,(H,18,21)/t14-/m0/s1