methyl (2S,3S,4R,5S,6R)-5-azido-3-oxidanyl-4-phenylmethoxy-6-phenylsulfanyl-oxane-2-carboxylate

Systemtic Name: methyl (2S,3S,4R,5S,6R)-5-azido-3-oxidanyl-4-phenylmethoxy-6-phenylsulfanyl-oxane-2-carboxylate Openeye Name: methyl (2S,3S,4R,5S,6R)-5-azido-4-benzyloxy-3-hydroxy-6-phenylsulfanyl-tetrahydropyran-2-carboxylate CAS Name: (2S,3S,4R,5S,6R)-5-azido-3-hydroxy-4-phenylmethoxy-6-(phenylthio)-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4R,5S,6R)-5-azido-3-hydroxy-4-phenylmethoxy-6-phenylsulfanyloxane-2-carboxylate Traditional Name: (2S,3S,4R,5S,6R)-5-azido-4-benzoxy-3-hydroxy-6-(phenylthio)tetrahydropyran-2-carboxylic acid methyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(C(C(O1)SC2=CC=CC=C2)N=[N+]=[N-])OCC3=CC=CC=C3)O

Isomeric SMILES

COC(=O)[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)SC2=CC=CC=C2)N=[N+]=[N-])OCC3=CC=CC=C3)O

InChI

InChI=1S/C20H21N3O5S/c1-26-19(25)18-16(24)17(27-12-13-8-4-2-5-9-13)15(22-23-21)20(28-18)29-14-10-6-3-7-11-14/h2-11,15-18,20,24H,12H2,1H3/t15-,16-,17+,18-,20+/m0/s1