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

Systemtic Name: ethyl (4S)-4-ethyl-2-oxidanylidene-6-[[(3S)-3-phenylbutanoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-2-oxo-6-[[(3S)-3-phenylbutanoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-2-oxo-6-[[(3S)-1-oxo-3-phenylbutoxy]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-2-oxo-6-[[(3S)-3-phenylbutanoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-2-keto-6-[[(3S)-3-phenylbutanoyl]oxymethyl]-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)CC(C)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O5/c1-4-15-18(19(24)26-5-2)16(22-20(25)21-15)12-27-17(23)11-13(3)14-9-7-6-8-10-14/h6-10,13,15H,4-5,11-12H2,1-3H3,(H2,21,22,25)/t13-,15-/m0/s1