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

Systemtic Name: 5-methyl-3-(3-oxidanidyl-3-oxidanylidene-propyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-3-(3-oxido-3-oxo-propyl)-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-(3-oxido-3-oxopropyl)-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 5-methyl-3-(3-oxido-3-oxopropyl)-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-(3-keto-3-oxido-propyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C11H8N2O5S-2 MolecularWeight: 280.25662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C11H10N2O5S/c1-5-7-9(19-8(5)11(17)18)12-4-13(10(7)16)3-2-6(14)15/h4H,2-3H2,1H3,(H,14,15)(H,17,18)/p-2