(3S,4S,5S,6S)-5-azido-6-(4-nitrophenyl)sulfanyl-thiane-3,4-diol

Systemtic Name: (3S,4S,5S,6S)-5-azido-6-(4-nitrophenyl)sulfanyl-thiane-3,4-diol Openeye Name: (3S,4S,5S,6S)-5-azido-6-(4-nitrophenyl)sulfanyl-tetrahydrothiopyran-3,4-diol CAS Name: (3S,4S,5S,6S)-5-azido-6-[(4-nitrophenyl)thio]thiane-3,4-diol IUPAC Name: (3S,4S,5S,6S)-5-azido-6-(4-nitrophenyl)sulfanylthiane-3,4-diol Traditional Name: (3S,4S,5S,6S)-5-azido-6-[(4-nitrophenyl)thio]tetrahydrothiopyran-3,4-diol Formula: C11H12N4O4S2 MolecularWeight: 328.36738

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(S1)SC2=CC=C(C=C2)[N+](=O)[O-])N=[N+]=[N-])O)O

Isomeric SMILES

C1[C@H]([C@H]([C@@H]([C@@H](S1)SC2=CC=C(C=C2)[N+](=O)[O-])N=[N+]=[N-])O)O

InChI

InChI=1S/C11H12N4O4S2/c12-14-13-9-10(17)8(16)5-20-11(9)21-7-3-1-6(2-4-7)15(18)19/h1-4,8-11,16-17H,5H2/t8-,9+,10-,11+/m1/s1