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

Systemtic Name: ethyl (4S)-4-ethyl-6-[2-[(2-fluorophenyl)carbonylamino]ethanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-6-[[2-[(2-fluorobenzoyl)amino]acetyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-6-[[2-[[(2-fluorophenyl)-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-[(2-fluorobenzoyl)amino]acetyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-6-[[2-[(2-fluorobenzoyl)amino]acetyl]oxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H22FN3O6 MolecularWeight: 407.392883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)CNC(=O)C2=CC=CC=C2F)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)CNC(=O)C2=CC=CC=C2F)C(=O)OCC

InChI

InChI=1S/C19H22FN3O6/c1-3-13-16(18(26)28-4-2)14(23-19(27)22-13)10-29-15(24)9-21-17(25)11-7-5-6-8-12(11)20/h5-8,13H,3-4,9-10H2,1-2H3,(H,21,25)(H2,22,23,27)/t13-/m0/s1