ethyl (4S)-4-(2-bromanyl-5-methoxy-phenyl)-6-(bromomethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-(2-bromanyl-5-methoxy-phenyl)-6-(bromomethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(2-bromo-5-methoxy-phenyl)-6-(bromomethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(2-bromo-5-methoxyphenyl)-6-(bromomethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(2-bromo-5-methoxyphenyl)-6-(bromomethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(2-bromo-5-methoxy-phenyl)-6-(bromomethyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C15H16Br2N2O4 MolecularWeight: 448.10654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=C(C=CC(=C2)OC)Br)CBr

Isomeric SMILES

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

InChI

InChI=1S/C15H16Br2N2O4/c1-3-23-14(20)12-11(7-16)18-15(21)19-13(12)9-6-8(22-2)4-5-10(9)17/h4-6,13H,3,7H2,1-2H3,(H2,18,19,21)/t13-/m1/s1