[(2S,3R,4S,6S)-6-(acetyloxymethyl)-4-azido-2-phenylsulfanyl-oxan-3-yl] 2,2-dimethylpropanoate

Systemtic Name: [(2S,3R,4S,6S)-6-(acetyloxymethyl)-4-azido-2-phenylsulfanyl-oxan-3-yl] 2,2-dimethylpropanoate Openeye Name: [(2S,3R,4S,6S)-6-(acetoxymethyl)-4-azido-2-phenylsulfanyl-tetrahydropyran-3-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(2S,3R,4S,6S)-6-(acetyloxymethyl)-4-azido-2-(phenylthio)-3-oxanyl] ester IUPAC Name: [(2S,3R,4S,6S)-6-(acetyloxymethyl)-4-azido-2-phenylsulfanyloxan-3-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(2S,3R,4S,6S)-6-(acetoxymethyl)-4-azido-2-(phenylthio)tetrahydropyran-3-yl] ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1CC(C(C(O1)SC2=CC=CC=C2)OC(=O)C(C)(C)C)N=[N+]=[N-]

Isomeric SMILES

CC(=O)OC[C@@H]1C[C@@H]([C@H]([C@@H](O1)SC2=CC=CC=C2)OC(=O)C(C)(C)C)N=[N+]=[N-]

InChI

InChI=1S/C19H25N3O5S/c1-12(23)25-11-13-10-15(21-22-20)16(27-18(24)19(2,3)4)17(26-13)28-14-8-6-5-7-9-14/h5-9,13,15-17H,10-11H2,1-4H3/t13-,15-,16+,17-/m0/s1