[[[[(2R,5S)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxy-oxidanidyl-phosphinothioyl]oxy-oxidanyl-phosphoryl]-bis(fluoranyl)methyl]phosphonic acid

Systemtic Name: [[[[(2R,5S)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxy-oxidanidyl-phosphinothioyl]oxy-oxidanyl-phosphoryl]-bis(fluoranyl)methyl]phosphonic acid Openeye Name: [[[[(2R,5S)-5-(4-amino-2-oxo-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxy-oxido-phosphinothioyl]oxy-hydroxy-phosphoryl]-difluoro-methyl]phosphonic acid CAS Name: [[[[(2R,5S)-5-(4-amino-2-oxo-1-pyrimidinyl)-1,3-oxathiolan-2-yl]methoxy-oxidophosphinothioyl]oxy-hydroxyphosphoryl]-difluoromethyl]phosphonic acid IUPAC Name: [[[[(2R,5S)-5-(4-amino-2-oxopyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxy-oxidophosphinothioyl]oxy-hydroxyphosphoryl]-difluoromethyl]phosphonic acid Traditional Name: [[[[(2R,5S)-5-(4-amino-2-keto-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxy-oxido-thiophosphoryl]oxy-hydroxy-phosphoryl]-difluoro-methyl]phosphonic acid Formula: C9H13F2N3O10P3S2- MolecularWeight: 518.261709

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(S1)COP(=S)([O-])OP(=O)(C(F)(F)P(=O)(O)O)O)N2C=CC(=NC2=O)N

Isomeric SMILES

C1[C@H](O[C@H](S1)COP(=S)([O-])OP(=O)(C(F)(F)P(=O)(O)O)O)N2C=CC(=NC2=O)N

InChI

InChI=1S/C9H14F2N3O10P3S2/c10-9(11,25(16,17)18)26(19,20)24-27(21,28)22-3-7-23-6(4-29-7)14-2-1-5(12)13-8(14)15/h1-2,6-7H,3-4H2,(H,19,20)(H,21,28)(H2,12,13,15)(H2,16,17,18)/p-1/t6-,7+,27?/m0/s1