ethyl (4R)-4-ethyl-2-oxidanylidene-6-(4-thiophen-2-ylbutanoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-4-ethyl-2-oxidanylidene-6-(4-thiophen-2-ylbutanoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-4-ethyl-2-oxo-6-[4-(2-thienyl)butanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-ethyl-2-oxo-6-[(1-oxo-4-thiophen-2-ylbutoxy)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-4-ethyl-2-oxo-6-(4-thiophen-2-ylbutanoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-ethyl-2-keto-6-[4-(2-thienyl)butanoyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)CCCC2=CC=CS2)C(=O)OCC

Isomeric SMILES

CC[C@@H]1C(=C(NC(=O)N1)COC(=O)CCCC2=CC=CS2)C(=O)OCC

InChI

InChI=1S/C18H24N2O5S/c1-3-13-16(17(22)24-4-2)14(20-18(23)19-13)11-25-15(21)9-5-7-12-8-6-10-26-12/h6,8,10,13H,3-5,7,9,11H2,1-2H3,(H2,19,20,23)/t13-/m1/s1