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

Systemtic Name: methyl (4S)-4-[3,5-bis(bromanyl)-2-oxidanyl-phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (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 methyl ester IUPAC Name: methyl (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 methyl ester Formula: C13H12Br2N2O4 MolecularWeight: 420.05338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC(=CC(=C2O)Br)Br)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1)C2=CC(=CC(=C2O)Br)Br)C(=O)OC

InChI

InChI=1S/C13H12Br2N2O4/c1-5-9(12(19)21-2)10(17-13(20)16-5)7-3-6(14)4-8(15)11(7)18/h3-4,10,18H,1-2H3,(H2,16,17,20)/t10-/m0/s1