ethyl (4S)-4-ethyl-6-[2-[(3-methylphenyl)carbonylamino]ethanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-6-[2-[(3-methylphenyl)carbonylamino]ethanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-6-[[2-[(3-methylbenzoyl)amino]acetyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-6-[[2-[[(3-methylphenyl)-oxomethyl]amino]-1-oxoethoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-6-[[2-[(3-methylbenzoyl)amino]acetyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-2-keto-6-[[2-(m-toluoylamino)acetyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H25N3O6 MolecularWeight: 403.429

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O6/c1-4-14-17(19(26)28-5-2)15(23-20(27)22-14)11-29-16(24)10-21-18(25)13-8-6-7-12(3)9-13/h6-9,14H,4-5,10-11H2,1-3H3,(H,21,25)(H2,22,23,27)/t14-/m0/s1