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

Systemtic Name: ethyl (4S)-4-ethyl-2-oxidanylidene-6-[[(2S)-2-(phenylcarbamoylamino)propanoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-2-oxo-6-[[(2S)-2-(phenylcarbamoylamino)propanoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(2S)-2-[[anilino(oxo)methyl]amino]-1-oxopropoxy]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-2-oxo-6-[[(2S)-2-(phenylcarbamoylamino)propanoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-2-keto-6-[[(2S)-2-(phenylcarbamoylamino)propanoyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H26N4O6 MolecularWeight: 418.44364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C(C)NC(=O)NC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)[C@H](C)NC(=O)NC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C20H26N4O6/c1-4-14-16(18(26)29-5-2)15(24-20(28)23-14)11-30-17(25)12(3)21-19(27)22-13-9-7-6-8-10-13/h6-10,12,14H,4-5,11H2,1-3H3,(H2,21,22,27)(H2,23,24,28)/t12-,14-/m0/s1