ethyl (4S)-4-ethyl-2-oxidanylidene-6-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-2-oxidanylidene-6-[(4-oxidanylidene-4-thiophen-2-yl-butanoyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-2-oxo-6-[[4-oxo-4-(2-thienyl)butanoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[(1,4-dioxo-4-thiophen-2-ylbutoxy)methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-2-oxo-6-[(4-oxo-4-thiophen-2-ylbutanoyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-2-keto-6-[[4-keto-4-(2-thienyl)butanoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H22N2O6S MolecularWeight: 394.44208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)CCC(=O)C2=CC=CS2)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)CCC(=O)C2=CC=CS2)C(=O)OCC

InChI

InChI=1S/C18H22N2O6S/c1-3-11-16(17(23)25-4-2)12(20-18(24)19-11)10-26-15(22)8-7-13(21)14-6-5-9-27-14/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H2,19,20,24)/t11-/m0/s1