2-ethyl-5-methyl-3-(3-oxidanidyl-3-oxidanylidene-propyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-ethyl-5-methyl-3-(3-oxidanidyl-3-oxidanylidene-propyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-ethyl-5-methyl-3-(3-oxido-3-oxo-propyl)-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-ethyl-5-methyl-3-(3-oxido-3-oxopropyl)-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 2-ethyl-5-methyl-3-(3-oxido-3-oxopropyl)-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-ethyl-4-keto-3-(3-keto-3-oxido-propyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C13H12N2O5S-2 MolecularWeight: 308.30978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=C(S2)C(=O)[O-])C)C(=O)N1CCC(=O)[O-]

Isomeric SMILES

CCC1=NC2=C(C(=C(S2)C(=O)[O-])C)C(=O)N1CCC(=O)[O-]

InChI

InChI=1S/C13H14N2O5S/c1-3-7-14-11-9(6(2)10(21-11)13(19)20)12(18)15(7)5-4-8(16)17/h3-5H2,1-2H3,(H,16,17)(H,19,20)/p-2