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

Systemtic Name: methyl (6S)-6-(2-bromophenyl)-3-cyclopropyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6S)-6-(2-bromophenyl)-3-cyclopropyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-(2-bromophenyl)-3-cyclopropyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6S)-6-(2-bromophenyl)-3-cyclopropyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-6-(2-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=C3Br)C(=O)OC

Isomeric SMILES

CC1=C([C@H](NC(=O)N1C2CC2)C3=CC=CC=C3Br)C(=O)OC

InChI

InChI=1S/C16H17BrN2O3/c1-9-13(15(20)22-2)14(11-5-3-4-6-12(11)17)18-16(21)19(9)10-7-8-10/h3-6,10,14H,7-8H2,1-2H3,(H,18,21)/t14-/m1/s1