ethyl (4S)-4-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(3,5-dibromo-2-hydroxy-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(3,5-dibromo-2-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(3,5-dibromo-2-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(3,5-dibromo-2-hydroxy-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C14H14Br2N2O4 MolecularWeight: 434.07996

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC(=C2O)Br)Br)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC(=CC(=C2O)Br)Br)C

InChI

InChI=1S/C14H14Br2N2O4/c1-3-22-13(20)10-6(2)17-14(21)18-11(10)8-4-7(15)5-9(16)12(8)19/h4-5,11,19H,3H2,1-2H3,(H2,17,18,21)/t11-/m0/s1