(2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-[2,2-bis(fluoranyl)-1-sulfanyl-ethyl]oxolane-3,4-diol

Systemtic Name: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-[2,2-bis(fluoranyl)-1-sulfanyl-ethyl]oxolane-3,4-diol Openeye Name: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(2,2-difluoro-1-sulfanyl-ethyl)tetrahydrofuran-3,4-diol CAS Name: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(2,2-difluoro-1-mercaptoethyl)oxolane-3,4-diol IUPAC Name: (2R,3R,4S,5S)-2-(6-aminopurin-9-yl)-5-(2,2-difluoro-1-sulfanylethyl)oxolane-3,4-diol Traditional Name: (2R,3R,4S,5S)-2-adenin-9-yl-5-(2,2-difluoro-1-mercapto-ethyl)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)C(C(F)F)S)O)O

Isomeric SMILES

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

InChI

InChI=1S/C11H13F2N5O3S/c12-8(13)7(22)6-4(19)5(20)11(21-6)18-2-17-3-9(14)15-1-16-10(3)18/h1-2,4-8,11,19-20,22H,(H2,14,15,16)/t4-,5+,6-,7?,11+/m0/s1