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

Systemtic Name: ethyl (6S)-6-(3-bromanyl-4-fluoranyl-phenyl)-3-(2-methoxyethyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl (6S)-6-(3-bromo-4-fluoro-phenyl)-3-(2-methoxyethyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-(3-bromo-4-fluorophenyl)-3-(2-methoxyethyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (6S)-6-(3-bromo-4-fluorophenyl)-3-(2-methoxyethyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-(3-bromo-4-fluoro-phenyl)-2-keto-3-(2-methoxyethyl)-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C17H20BrFN2O4 MolecularWeight: 415.254103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=C(C=C2)F)Br)CCOC)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)N[C@H]1C2=CC(=C(C=C2)F)Br)CCOC)C

InChI

InChI=1S/C17H20BrFN2O4/c1-4-25-16(22)14-10(2)21(7-8-24-3)17(23)20-15(14)11-5-6-13(19)12(18)9-11/h5-6,9,15H,4,7-8H2,1-3H3,(H,20,23)/t15-/m0/s1