ethyl (4S)-4-ethyl-2-oxidanylidene-6-[(4-propan-2-ylphenyl)carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-2-oxidanylidene-6-[(4-propan-2-ylphenyl)carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-6-[(4-isopropylbenzoyl)oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-2-oxo-6-[[oxo-(4-propan-2-ylphenyl)methoxy]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-2-oxo-6-[(4-propan-2-ylbenzoyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-(cumoyloxymethyl)-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O5/c1-5-15-17(19(24)26-6-2)16(22-20(25)21-15)11-27-18(23)14-9-7-13(8-10-14)12(3)4/h7-10,12,15H,5-6,11H2,1-4H3,(H2,21,22,25)/t15-/m0/s1