5-methyl-4-oxidanylidene-2-pyridin-3-yl-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 5-methyl-4-oxidanylidene-2-pyridin-3-yl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 5-methyl-4-oxo-2-(3-pyridyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-(3-pyridinyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 5-methyl-4-oxo-2-pyridin-3-yl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-(3-pyridyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C13H8N3O3S- MolecularWeight: 286.28592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9N3O3S/c1-6-8-11(17)15-10(7-3-2-4-14-5-7)16-12(8)20-9(6)13(18)19/h2-5H,1H3,(H,18,19)(H,15,16,17)/p-1