4-(5-methoxycarbonyl-4-methyl-2-oxidanylidene-6-thiophen-2-yl-1,6-dihydropyrimidin-3-yl)butanoic acid

Systemtic Name: 4-(5-methoxycarbonyl-4-methyl-2-oxidanylidene-6-thiophen-2-yl-1,6-dihydropyrimidin-3-yl)butanoic acid Openeye Name: 4-[5-methoxycarbonyl-4-methyl-2-oxo-6-(2-thienyl)-1,6-dihydropyrimidin-3-yl]butanoic acid CAS Name: 4-(5-methoxycarbonyl-4-methyl-2-oxo-6-thiophen-2-yl-1,6-dihydropyrimidin-3-yl)butanoic acid IUPAC Name: 4-(5-methoxycarbonyl-4-methyl-2-oxo-6-thiophen-2-yl-1,6-dihydropyrimidin-3-yl)butanoic acid Traditional Name: 4-[5-carbomethoxy-2-keto-4-methyl-6-(2-thienyl)-1,6-dihydropyrimidin-3-yl]butyric acid Formula: C15H18N2O5S MolecularWeight: 338.37882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CCCC(=O)O)C2=CC=CS2)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1CCCC(=O)O)C2=CC=CS2)C(=O)OC

InChI

InChI=1S/C15H18N2O5S/c1-9-12(14(20)22-2)13(10-5-4-8-23-10)16-15(21)17(9)7-3-6-11(18)19/h4-5,8,13H,3,6-7H2,1-2H3,(H,16,21)(H,18,19)