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

Systemtic Name: 2-methoxyethyl (6S)-6-(3-bromanyl-4-fluoranyl-phenyl)-3-(4-methoxyphenyl)-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6S)-6-(3-bromo-4-fluoro-phenyl)-3-(4-methoxyphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-(3-bromo-4-fluorophenyl)-3-(4-methoxyphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6S)-6-(3-bromo-4-fluorophenyl)-3-(4-methoxyphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-(3-bromo-4-fluoro-phenyl)-2-keto-3-(4-methoxyphenyl)-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C22H22BrFN2O5 MolecularWeight: 493.322883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C2=CC=C(C=C2)OC)C3=CC(=C(C=C3)F)Br)C(=O)OCCOC

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1C2=CC=C(C=C2)OC)C3=CC(=C(C=C3)F)Br)C(=O)OCCOC

InChI

InChI=1S/C22H22BrFN2O5/c1-13-19(21(27)31-11-10-29-2)20(14-4-9-18(24)17(23)12-14)25-22(28)26(13)15-5-7-16(30-3)8-6-15/h4-9,12,20H,10-11H2,1-3H3,(H,25,28)/t20-/m0/s1