ethyl (4S)-4-(furan-2-yl)-6-[[(3-nitrophenyl)amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-(furan-2-yl)-6-[[(3-nitrophenyl)amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-(2-furyl)-6-[(3-nitroanilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-(2-furanyl)-6-[(3-nitroanilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(furan-2-yl)-6-[(3-nitroanilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-(2-furyl)-2-keto-6-[(3-nitroanilino)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H18N4O6 MolecularWeight: 386.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CO2)CNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C2=CC=CO2)CNC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6/c1-2-27-17(23)15-13(10-19-11-5-3-6-12(9-11)22(25)26)20-18(24)21-16(15)14-7-4-8-28-14/h3-9,16,19H,2,10H2,1H3,(H2,20,21,24)/t16-/m1/s1