methyl (4S)-4-(3-bromophenyl)-1,3,6-trimethyl-2-oxidanylidene-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-4-(3-bromophenyl)-1,3,6-trimethyl-2-oxidanylidene-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-4-(3-bromophenyl)-1,3,6-trimethyl-2-oxo-4H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(3-bromophenyl)-1,3,6-trimethyl-2-oxo-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-4-(3-bromophenyl)-1,3,6-trimethyl-2-oxo-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(3-bromophenyl)-2-keto-1,3,6-trimethyl-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C15H17BrN2O3 MolecularWeight: 353.21108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N(C(=O)N1C)C)C2=CC(=CC=C2)Br)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](N(C(=O)N1C)C)C2=CC(=CC=C2)Br)C(=O)OC

InChI

InChI=1S/C15H17BrN2O3/c1-9-12(14(19)21-4)13(18(3)15(20)17(9)2)10-6-5-7-11(16)8-10/h5-8,13H,1-4H3/t13-/m0/s1