5-methyl-3-[(2-methylfuran-3-yl)carbonylamino]-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 5-methyl-3-[(2-methylfuran-3-yl)carbonylamino]-4-oxidanylidene-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 5-methyl-3-[(2-methylfuran-3-carbonyl)amino]-4-oxo-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-3-[[(2-methyl-3-furanyl)-oxomethyl]amino]-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid IUPAC Name: 5-methyl-3-[(2-methylfuran-3-carbonyl)amino]-4-oxo-2-sulfanylidene-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-keto-5-methyl-3-[(2-methyl-3-furoyl)amino]-2-thioxo-1H-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C14H11N3O5S2 MolecularWeight: 365.38424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=S)N2)NC(=O)C3=C(OC=C3)C)C(=O)O

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=S)N2)NC(=O)C3=C(OC=C3)C)C(=O)O

InChI

InChI=1S/C14H11N3O5S2/c1-5-8-11(24-9(5)13(20)21)15-14(23)17(12(8)19)16-10(18)7-3-4-22-6(7)2/h3-4H,1-2H3,(H,15,23)(H,16,18)(H,20,21)