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

Systemtic Name: methyl (6S)-6-(3-bromophenyl)-4-methyl-2-oxidanylidene-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6S)-3-allyl-6-(3-bromophenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-6-(3-bromophenyl)-4-methyl-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6S)-6-(3-bromophenyl)-4-methyl-2-oxo-3-prop-2-enyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-allyl-6-(3-bromophenyl)-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)N1CC=C)C2=CC(=CC=C2)Br)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1CC=C)C2=CC(=CC=C2)Br)C(=O)OC

InChI

InChI=1S/C16H17BrN2O3/c1-4-8-19-10(2)13(15(20)22-3)14(18-16(19)21)11-6-5-7-12(17)9-11/h4-7,9,14H,1,8H2,2-3H3,(H,18,21)/t14-/m0/s1