[(2R,3S,4R,5S,6R)-4-acetyloxy-5-azido-6-ethylsulfanyl-2-(hydroxymethyl)oxan-3-yl] ethanoate

Systemtic Name: [(2R,3S,4R,5S,6R)-4-acetyloxy-5-azido-6-ethylsulfanyl-2-(hydroxymethyl)oxan-3-yl] ethanoate Openeye Name: [(2R,3S,4R,5S,6R)-4-acetoxy-5-azido-6-ethylsulfanyl-2-(hydroxymethyl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2R,3S,4R,5S,6R)-4-acetyloxy-5-azido-6-(ethylthio)-2-(hydroxymethyl)-3-oxanyl] ester IUPAC Name: [(2R,3S,4R,5S,6R)-4-acetyloxy-5-azido-6-ethylsulfanyl-2-(hydroxymethyl)oxan-3-yl] acetate Traditional Name: acetic acid [(2R,3S,4R,5S,6R)-4-acetoxy-5-azido-6-(ethylthio)-2-methylol-tetrahydropyran-3-yl] ester Formula: C12H19N3O6S MolecularWeight: 333.36076

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1C(C(C(C(O1)CO)OC(=O)C)OC(=O)C)N=[N+]=[N-]

Isomeric SMILES

CCS[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)OC(=O)C)OC(=O)C)N=[N+]=[N-]

InChI

InChI=1S/C12H19N3O6S/c1-4-22-12-9(14-15-13)11(20-7(3)18)10(19-6(2)17)8(5-16)21-12/h8-12,16H,4-5H2,1-3H3/t8-,9+,10-,11-,12-/m1/s1