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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O6/c1-3-14-17(18(26)29-4-2)15(24-20(28)23-14)12-30-16(25)10-11-21-19(27)22-13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3,(H2,21,22,27)(H2,23,24,28)/t14-/m0/s1