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

Systemtic Name: [[[[(2S,3S,5R)-3-azanyl-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methoxy-oxidanyl-phosphinothioyl]oxy-oxidanyl-phosphoryl]-bis(fluoranyl)methyl]phosphonic acid Openeye Name: [[[[(2S,3S,5R)-3-amino-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphinothioyl]oxy-hydroxy-phosphoryl]-difluoro-methyl]phosphonic acid CAS Name: [[[[(2S,3S,5R)-3-amino-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methoxy-hydroxyphosphinothioyl]oxy-hydroxyphosphoryl]-difluoromethyl]phosphonic acid IUPAC Name: [[[[(2S,3S,5R)-3-amino-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphinothioyl]oxy-hydroxyphosphoryl]-difluoromethyl]phosphonic acid Traditional Name: [[[[(2S,3S,5R)-3-amino-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-thiophosphoryl]oxy-hydroxy-phosphoryl]-difluoro-methyl]phosphonic acid Formula: C11H18F2N3O11P3S MolecularWeight: 531.257209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=S)(O)OP(=O)(C(F)(F)P(=O)(O)O)O)N

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=S)(O)OP(=O)(C(F)(F)P(=O)(O)O)O)N

InChI

InChI=1S/C11H18F2N3O11P3S/c1-5-3-16(10(18)15-9(5)17)8-2-6(14)7(26-8)4-25-30(24,31)27-29(22,23)11(12,13)28(19,20)21/h3,6-8H,2,4,14H2,1H3,(H,22,23)(H,24,31)(H,15,17,18)(H2,19,20,21)/t6-,7+,8+,30?/m0/s1