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

Systemtic Name: [5-(4-azanyl-5-chloranyl-2-sulfanylidene-pyrimidin-1-yl)-4-methoxy-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate Openeye Name: [5-(4-amino-5-chloro-2-thioxo-pyrimidin-1-yl)-4-methoxy-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate CAS Name: [5-(4-amino-5-chloro-2-sulfanylidene-1-pyrimidinyl)-4-methoxy-2-(phosphonooxymethyl)-3-oxolanyl] dihydrogen phosphate IUPAC Name: [5-(4-amino-5-chloro-2-sulfanylidenepyrimidin-1-yl)-4-methoxy-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate Traditional Name: [5-(4-amino-5-chloro-2-thioxo-pyrimidin-1-yl)-4-methoxy-2-(phosphonooxymethyl)tetrahydrofuran-3-yl] dihydrogen phosphate Formula: C10H16ClN3O10P2S MolecularWeight: 467.713662

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(OC1N2C=C(C(=NC2=S)N)Cl)COP(=O)(O)O)OP(=O)(O)O

Isomeric SMILES

COC1C(C(OC1N2C=C(C(=NC2=S)N)Cl)COP(=O)(O)O)OP(=O)(O)O

InChI

InChI=1S/C10H16ClN3O10P2S/c1-21-7-6(24-26(18,19)20)5(3-22-25(15,16)17)23-9(7)14-2-4(11)8(12)13-10(14)27/h2,5-7,9H,3H2,1H3,(H2,12,13,27)(H2,15,16,17)(H2,18,19,20)