bis[[(2S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl] (4-methylsulfonylphenyl) phosphate

Systemtic Name: bis[[(2S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl] (4-methylsulfonylphenyl) phosphate Openeye Name: bis[[(2S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl] (4-methylsulfonylphenyl) phosphate CAS Name: phosphoric acid bis[[(2S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-2,5-dihydrofuran-2-yl]methyl] (4-methylsulfonylphenyl) ester IUPAC Name: bis[[(2S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl] (4-methylsulfonylphenyl) phosphate Traditional Name: phosphoric acid bis[[(2S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl] (4-mesylphenyl) ester Formula: C25H27N6O10PS MolecularWeight: 634.554841

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)OP(=O)(OCC2C=CC(O2)N3C=CC(=NC3=O)N)OCC4C=CC(O4)N5C=CC(=NC5=O)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)OP(=O)(OC[C@@H]2C=C[C@@H](O2)N3C=CC(=NC3=O)N)OC[C@@H]4C=C[C@@H](O4)N5C=CC(=NC5=O)N

InChI

InChI=1S/C25H27N6O10PS/c1-43(35,36)19-6-2-16(3-7-19)41-42(34,37-14-17-4-8-22(39-17)30-12-10-20(26)28-24(30)32)38-15-18-5-9-23(40-18)31-13-11-21(27)29-25(31)33/h2-13,17-18,22-23H,14-15H2,1H3,(H2,26,28,32)(H2,27,29,33)/t17-,18-,22+,23+/m0/s1