methyl (6S)-4-methyl-3-(3-methylbutyl)-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6S)-4-methyl-3-(3-methylbutyl)-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6S)-3-isopentyl-4-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-4-methyl-3-(3-methylbutyl)-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6S)-4-methyl-3-(3-methylbutyl)-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-isoamyl-2-keto-4-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCC(C)C)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1CCC(C)C)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H24N2O3/c1-12(2)10-11-20-13(3)15(17(21)23-4)16(19-18(20)22)14-8-6-5-7-9-14/h5-9,12,16H,10-11H2,1-4H3,(H,19,22)/t16-/m0/s1