methyl (6S)-6-(3-bromophenyl)-3-cyclopropyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6S)-6-(3-bromophenyl)-3-cyclopropyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6S)-6-(3-bromophenyl)-3-cyclopropyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-(3-bromophenyl)-3-cyclopropyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6S)-6-(3-bromophenyl)-3-cyclopropyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-(3-bromophenyl)-3-cyclopropyl-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C16H17BrN2O3 MolecularWeight: 365.22178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C2CC2)C3=CC(=CC=C3)Br)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1C2CC2)C3=CC(=CC=C3)Br)C(=O)OC

InChI

InChI=1S/C16H17BrN2O3/c1-9-13(15(20)22-2)14(10-4-3-5-11(17)8-10)18-16(21)19(9)12-6-7-12/h3-5,8,12,14H,6-7H2,1-2H3,(H,18,21)/t14-/m0/s1