[2,4-bis(oxidanylidene)-5-thiophen-3-yl-1H-pyrimidin-6-yl]oxymethylphosphonic acid

Systemtic Name: [2,4-bis(oxidanylidene)-5-thiophen-3-yl-1H-pyrimidin-6-yl]oxymethylphosphonic acid Openeye Name: [2,4-dioxo-5-(3-thienyl)-1H-pyrimidin-6-yl]oxymethylphosphonic acid CAS Name: [2,4-dioxo-5-(3-thiophenyl)-1H-pyrimidin-6-yl]oxymethylphosphonic acid IUPAC Name: (2,4-dioxo-5-thiophen-3-yl-1H-pyrimidin-6-yl)oxymethylphosphonic acid Traditional Name: [2,4-diketo-5-(3-thienyl)-1H-pyrimidin-6-yl]oxymethylphosphonic acid Formula: C9H9N2O6PS MolecularWeight: 304.216321

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1C2=C(NC(=O)NC2=O)OCP(=O)(O)O

Isomeric SMILES

C1=CSC=C1C2=C(NC(=O)NC2=O)OCP(=O)(O)O

InChI

InChI=1S/C9H9N2O6PS/c12-7-6(5-1-2-19-3-5)8(11-9(13)10-7)17-4-18(14,15)16/h1-3H,4H2,(H2,14,15,16)(H2,10,11,12,13)