2-[[5-(furan-2-yl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[5-(furan-2-yl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-(2-furyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]acetic acid CAS Name: 2-[[5-(2-furanyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]thio]acetic acid IUPAC Name: 2-[[5-(furan-2-yl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-(2-furyl)-4-keto-3H-thieno[2,3-d]pyrimidin-2-yl]thio]acetic acid Formula: C12H8N2O4S2 MolecularWeight: 308.33292

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=CSC3=C2C(=O)NC(=N3)SCC(=O)O

Isomeric SMILES

C1=COC(=C1)C2=CSC3=C2C(=O)NC(=N3)SCC(=O)O

InChI

InChI=1S/C12H8N2O4S2/c15-8(16)5-20-12-13-10(17)9-6(4-19-11(9)14-12)7-2-1-3-18-7/h1-4H,5H2,(H,15,16)(H,13,14,17)