4-[5-ethoxycarbonyl-4-methyl-2-oxidanylidene-6-(2-thiophen-2-ylcarbonyloxyphenyl)-1,6-dihydropyrimidin-3-yl]butanoic acid

Systemtic Name: 4-[5-ethoxycarbonyl-4-methyl-2-oxidanylidene-6-(2-thiophen-2-ylcarbonyloxyphenyl)-1,6-dihydropyrimidin-3-yl]butanoic acid Openeye Name: 4-[5-ethoxycarbonyl-4-methyl-2-oxo-6-[2-(thiophene-2-carbonyloxy)phenyl]-1,6-dihydropyrimidin-3-yl]butanoic acid CAS Name: 4-[5-ethoxycarbonyl-4-methyl-2-oxo-6-[2-[oxo(thiophen-2-yl)methoxy]phenyl]-1,6-dihydropyrimidin-3-yl]butanoic acid IUPAC Name: 4-[5-ethoxycarbonyl-4-methyl-2-oxo-6-[2-(thiophene-2-carbonyloxy)phenyl]-1,6-dihydropyrimidin-3-yl]butanoic acid Traditional Name: 4-[5-carbethoxy-2-keto-4-methyl-6-[2-(2-thenoyloxy)phenyl]-1,6-dihydropyrimidin-3-yl]butyric acid Formula: C23H24N2O7S MolecularWeight: 472.51086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2OC(=O)C3=CC=CS3)CCCC(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2OC(=O)C3=CC=CS3)CCCC(=O)O)C

InChI

InChI=1S/C23H24N2O7S/c1-3-31-22(29)19-14(2)25(12-6-11-18(26)27)23(30)24-20(19)15-8-4-5-9-16(15)32-21(28)17-10-7-13-33-17/h4-5,7-10,13,20H,3,6,11-12H2,1-2H3,(H,24,30)(H,26,27)