O4-ethyl O2-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O4-ethyl O2-[2-oxo-2-(pyrimidin-2-ylamino)ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[2-oxo-2-(2-pyrimidinylamino)ethyl] ester IUPAC Name: 4-O-ethyl 2-O-[2-oxo-2-(pyrimidin-2-ylamino)ethyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylic acid O4-ethyl ester O2-[2-keto-2-(2-pyrimidylamino)ethyl] ester Formula: C16H18N4O5 MolecularWeight: 346.33792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=NC=CC=N2)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)OCC(=O)NC2=NC=CC=N2)C

InChI

InChI=1S/C16H18N4O5/c1-4-24-14(22)12-9(2)13(19-10(12)3)15(23)25-8-11(21)20-16-17-6-5-7-18-16/h5-7,19H,4,8H2,1-3H3,(H,17,18,20,21)