[5-(5-cyano-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)-2-(hydroxymethyl)-4-methoxy-thiolan-3-yl] dihydrogen phosphate

Systemtic Name: [5-(5-cyano-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)-2-(hydroxymethyl)-4-methoxy-thiolan-3-yl] dihydrogen phosphate Openeye Name: [5-(5-cyano-4-oxo-2-thioxo-pyrimidin-1-yl)-2-(hydroxymethyl)-4-methoxy-tetrahydrothiophen-3-yl] dihydrogen phosphate CAS Name: [5-(5-cyano-4-oxo-2-sulfanylidene-1-pyrimidinyl)-2-(hydroxymethyl)-4-methoxy-3-thiolanyl] dihydrogen phosphate IUPAC Name: [5-(5-cyano-4-oxo-2-sulfanylidenepyrimidin-1-yl)-2-(hydroxymethyl)-4-methoxythiolan-3-yl] dihydrogen phosphate Traditional Name: [5-(5-cyano-4-keto-2-thioxo-pyrimidin-1-yl)-4-methoxy-2-methylol-tetrahydrothiophen-3-yl] dihydrogen phosphate Formula: C11H14N3O7PS2 MolecularWeight: 395.348521

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(SC1N2C=C(C(=O)NC2=S)C#N)CO)OP(=O)(O)O

Isomeric SMILES

COC1C(C(SC1N2C=C(C(=O)NC2=S)C#N)CO)OP(=O)(O)O

InChI

InChI=1S/C11H14N3O7PS2/c1-20-8-7(21-22(17,18)19)6(4-15)24-10(8)14-3-5(2-12)9(16)13-11(14)23/h3,6-8,10,15H,4H2,1H3,(H,13,16,23)(H2,17,18,19)