5-[(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)methyl]furan-2-carboxylate

Systemtic Name: 5-[(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)methyl]furan-2-carboxylate Openeye Name: 5-[(4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]furan-2-carboxylate CAS Name: 5-[(4-oxo-3-thieno[2,3-d]pyrimidinyl)methyl]-2-furancarboxylate IUPAC Name: 5-[(4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]furan-2-carboxylate Traditional Name: 5-[(4-ketothieno[2,3-d]pyrimidin-3-yl)methyl]-2-furoate Formula: C12H7N2O4S- MolecularWeight: 275.25998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1C(=O)N(C=N2)CC3=CC=C(O3)C(=O)[O-]

Isomeric SMILES

C1=CSC2=C1C(=O)N(C=N2)CC3=CC=C(O3)C(=O)[O-]

InChI

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