methyl (6R)-4-methyl-3-(3-methylbutyl)-2-oxidanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl (6R)-4-methyl-3-(3-methylbutyl)-2-oxidanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-3-isopentyl-4-methyl-2-oxo-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-4-methyl-3-(3-methylbutyl)-2-oxo-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-4-methyl-3-(3-methylbutyl)-2-oxo-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-3-isoamyl-2-keto-4-methyl-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O3S/c1-10(2)5-7-18-11(3)13(15(19)21-4)14(17-16(18)20)12-6-8-22-9-12/h6,8-10,14H,5,7H2,1-4H3,(H,17,20)/t14-/m0/s1