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

Systemtic Name: [5-(4-azanyl-5-oxidanyl-2-sulfanylidene-pyrimidin-1-yl)-4-oxidanyl-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate Openeye Name: [5-(4-amino-5-hydroxy-2-thioxo-pyrimidin-1-yl)-4-hydroxy-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate CAS Name: [5-(4-amino-5-hydroxy-2-sulfanylidene-1-pyrimidinyl)-4-hydroxy-2-(phosphonooxymethyl)-3-oxolanyl] dihydrogen phosphate IUPAC Name: [5-(4-amino-5-hydroxy-2-sulfanylidenepyrimidin-1-yl)-4-hydroxy-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate Traditional Name: [5-(4-amino-5-hydroxy-2-thioxo-pyrimidin-1-yl)-4-hydroxy-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate Formula: C9H15N3O11P2S MolecularWeight: 435.241422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15N3O11P2S/c10-7-3(13)1-12(9(26)11-7)8-5(14)6(23-25(18,19)20)4(22-8)2-21-24(15,16)17/h1,4-6,8,13-14H,2H2,(H2,10,11,26)(H2,15,16,17)(H2,18,19,20)