3-(furan-2-ylmethyl)-5-methyl-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 3-(furan-2-ylmethyl)-5-methyl-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 3-(2-furylmethyl)-5-methyl-4-oxo-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-(2-furanylmethyl)-5-methyl-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate IUPAC Name: 3-(furan-2-ylmethyl)-5-methyl-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(2-furfuryl)-4-keto-5-methyl-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C13H9N2O4S2- MolecularWeight: 321.35156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=S)N2)CC3=CC=CO3)C(=O)[O-]

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=S)N2)CC3=CC=CO3)C(=O)[O-]

InChI

InChI=1S/C13H10N2O4S2/c1-6-8-10(21-9(6)12(17)18)14-13(20)15(11(8)16)5-7-3-2-4-19-7/h2-4H,5H2,1H3,(H,14,20)(H,17,18)/p-1