2-(4-azanyl-2-methylsulfanyl-6-oxidanylidene-pyrimidin-1-yl)ethoxymethylphosphonic acid

Systemtic Name: 2-(4-azanyl-2-methylsulfanyl-6-oxidanylidene-pyrimidin-1-yl)ethoxymethylphosphonic acid Openeye Name: 2-(4-amino-2-methylsulfanyl-6-oxo-pyrimidin-1-yl)ethoxymethylphosphonic acid CAS Name: 2-[4-amino-2-(methylthio)-6-oxo-1-pyrimidinyl]ethoxymethylphosphonic acid IUPAC Name: 2-(4-amino-2-methylsulfanyl-6-oxopyrimidin-1-yl)ethoxymethylphosphonic acid Traditional Name: 2-[4-amino-6-keto-2-(methylthio)pyrimidin-1-yl]ethoxymethylphosphonic acid Formula: C8H14N3O5PS MolecularWeight: 295.252621

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=CC(=O)N1CCOCP(=O)(O)O)N

Isomeric SMILES

CSC1=NC(=CC(=O)N1CCOCP(=O)(O)O)N

InChI

InChI=1S/C8H14N3O5PS/c1-18-8-10-6(9)4-7(12)11(8)2-3-16-5-17(13,14)15/h4H,2-3,5,9H2,1H3,(H2,13,14,15)