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

Systemtic Name: 5-methyl-3-(2-oxidanidyl-2-oxidanylidene-ethyl)-4-oxidanylidene-2-pyridin-3-yl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-3-(2-oxido-2-oxo-ethyl)-4-oxo-2-(3-pyridyl)thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-(2-oxido-2-oxoethyl)-4-oxo-2-(3-pyridinyl)-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 5-methyl-3-(2-oxido-2-oxoethyl)-4-oxo-2-pyridin-3-ylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-(2-keto-2-oxido-ethyl)-5-methyl-2-(3-pyridyl)thieno[2,3-d]pyrimidine-6-carboxylate Formula: C15H9N3O5S-2 MolecularWeight: 343.31406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)C3=CN=CC=C3)CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)C3=CN=CC=C3)CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C15H11N3O5S/c1-7-10-13(24-11(7)15(22)23)17-12(8-3-2-4-16-5-8)18(14(10)21)6-9(19)20/h2-5H,6H2,1H3,(H,19,20)(H,22,23)/p-2