[(3S,4S,5R,6R)-4,5-diacetyloxy-6-(1-methylbenzimidazol-4-yl)oxy-thian-3-yl] ethanoate

Systemtic Name: [(3S,4S,5R,6R)-4,5-diacetyloxy-6-(1-methylbenzimidazol-4-yl)oxy-thian-3-yl] ethanoate Openeye Name: [(3S,4S,5R,6R)-4,5-diacetoxy-6-(1-methylbenzimidazol-4-yl)oxy-tetrahydrothiopyran-3-yl] acetate CAS Name: acetic acid [(3S,4S,5R,6R)-4,5-diacetyloxy-6-[(1-methyl-4-benzimidazolyl)oxy]-3-thianyl] ester IUPAC Name: [(3S,4S,5R,6R)-4,5-diacetyloxy-6-(1-methylbenzimidazol-4-yl)oxythian-3-yl] acetate Traditional Name: acetic acid [(3S,4S,5R,6R)-4,5-diacetoxy-6-(1-methylbenzimidazol-4-yl)oxy-tetrahydrothiopyran-3-yl] ester Formula: C19H22N2O7S MolecularWeight: 422.45218

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CSC(C(C1OC(=O)C)OC(=O)C)OC2=CC=CC3=C2N=CN3C

Isomeric SMILES

CC(=O)O[C@@H]1CS[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)OC2=CC=CC3=C2N=CN3C

InChI

InChI=1S/C19H22N2O7S/c1-10(22)25-15-8-29-19(18(27-12(3)24)17(15)26-11(2)23)28-14-7-5-6-13-16(14)20-9-21(13)4/h5-7,9,15,17-19H,8H2,1-4H3/t15-,17+,18-,19-/m1/s1