(2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-[bis(fluoranyl)methylsulfanylmethyl]oxolane-3,4-diol

Systemtic Name: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-[bis(fluoranyl)methylsulfanylmethyl]oxolane-3,4-diol Openeye Name: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(difluoromethylsulfanylmethyl)tetrahydrofuran-3,4-diol CAS Name: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-[(difluoromethylthio)methyl]oxolane-3,4-diol IUPAC Name: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(difluoromethylsulfanylmethyl)oxolane-3,4-diol Traditional Name: (2R,3R,4S,5S)-2-adenin-9-yl-5-[(difluoromethylthio)methyl]tetrahydrofuran-3,4-diol Formula: C11H13F2N5O3S MolecularWeight: 333.314426

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CSC(F)F)O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CSC(F)F)O)O

InChI

InChI=1S/C11H13F2N5O3S/c12-11(13)22-1-4-6(19)7(20)10(21-4)18-3-17-5-8(14)15-2-16-9(5)18/h2-4,6-7,10-11,19-20H,1H2,(H2,14,15,16)/t4-,6-,7-,10-/m1/s1