3-[(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)methyl]furan-2-carboxylic acid

Systemtic Name: 3-[(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)methyl]furan-2-carboxylic acid Openeye Name: 3-[(4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]furan-2-carboxylic acid CAS Name: 3-[(4-oxo-3-thieno[2,3-d]pyrimidinyl)methyl]-2-furancarboxylic acid IUPAC Name: 3-[(4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]furan-2-carboxylic acid Traditional Name: 3-[(4-ketothieno[2,3-d]pyrimidin-3-yl)methyl]-2-furoic acid Formula: C12H8N2O4S MolecularWeight: 276.26792

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1CN2C=NC3=C(C2=O)C=CS3)C(=O)O

Isomeric SMILES

C1=COC(=C1CN2C=NC3=C(C2=O)C=CS3)C(=O)O

InChI

InChI=1S/C12H8N2O4S/c15-11-8-2-4-19-10(8)13-6-14(11)5-7-1-3-18-9(7)12(16)17/h1-4,6H,5H2,(H,16,17)