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

Systemtic Name: ethyl (4S)-6-[[(2S)-2-benzamidopropanoyl]oxymethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[[(2S)-2-benzamidopropanoyl]oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(2S)-2-benzamido-1-oxopropoxy]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[[(2S)-2-benzamidopropanoyl]oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[[(2S)-2-benzamidopropanoyl]oxymethyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H25N3O6 MolecularWeight: 403.429

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O6/c1-4-14-16(19(26)28-5-2)15(23-20(27)22-14)11-29-18(25)12(3)21-17(24)13-9-7-6-8-10-13/h6-10,12,14H,4-5,11H2,1-3H3,(H,21,24)(H2,22,23,27)/t12-,14-/m0/s1