[4-oxidanyl-5-(5-oxidanyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate

Systemtic Name: [4-oxidanyl-5-(5-oxidanyl-4-oxidanylidene-2-sulfanylidene-pyrimidin-1-yl)-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate Openeye Name: [4-hydroxy-5-(5-hydroxy-4-oxo-2-thioxo-pyrimidin-1-yl)-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate CAS Name: [4-hydroxy-5-(5-hydroxy-4-oxo-2-sulfanylidene-1-pyrimidinyl)-2-(phosphonooxymethyl)-3-oxolanyl] dihydrogen phosphate IUPAC Name: [4-hydroxy-5-(5-hydroxy-4-oxo-2-sulfanylidenepyrimidin-1-yl)-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate Traditional Name: [4-hydroxy-5-(5-hydroxy-4-keto-2-thioxo-pyrimidin-1-yl)-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate Formula: C9H14N2O12P2S MolecularWeight: 436.226182

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NC(=S)N1C2C(C(C(O2)COP(=O)(O)O)OP(=O)(O)O)O)O

Isomeric SMILES

C1=C(C(=O)NC(=S)N1C2C(C(C(O2)COP(=O)(O)O)OP(=O)(O)O)O)O

InChI

InChI=1S/C9H14N2O12P2S/c12-3-1-11(9(26)10-7(3)14)8-5(13)6(23-25(18,19)20)4(22-8)2-21-24(15,16)17/h1,4-6,8,12-13H,2H2,(H,10,14,26)(H2,15,16,17)(H2,18,19,20)