ethyl (4S)-6-[(5-bromanyl-3-methyl-1-benzofuran-2-yl)carbonyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-6-[(5-bromanyl-3-methyl-1-benzofuran-2-yl)carbonyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[(5-bromo-3-methyl-benzofuran-2-carbonyl)oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(5-bromo-3-methyl-2-benzofuranyl)-oxomethoxy]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[(5-bromo-3-methyl-1-benzofuran-2-carbonyl)oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[(5-bromo-3-methyl-benzofuran-2-carbonyl)oxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H19BrN2O6 MolecularWeight: 451.26796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=C(C3=C(O2)C=CC(=C3)Br)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C)COC(=O)C2=C(C3=C(O2)C=CC(=C3)Br)C

InChI

InChI=1S/C19H19BrN2O6/c1-4-26-17(23)15-10(3)21-19(25)22-13(15)8-27-18(24)16-9(2)12-7-11(20)5-6-14(12)28-16/h5-7,10H,4,8H2,1-3H3,(H2,21,22,25)/t10-/m0/s1