[(2R,3S,5R,6S)-5-phenylmethoxy-2-(2-phenylsulfanylethynyl)-6-prop-2-enyl-oxan-3-yl] ethanoate

Systemtic Name: [(2R,3S,5R,6S)-5-phenylmethoxy-2-(2-phenylsulfanylethynyl)-6-prop-2-enyl-oxan-3-yl] ethanoate Openeye Name: [(2R,3S,5R,6S)-6-allyl-5-benzyloxy-2-(2-phenylsulfanylethynyl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(2R,3S,5R,6S)-5-phenylmethoxy-2-[2-(phenylthio)ethynyl]-6-prop-2-enyl-3-oxanyl] ester IUPAC Name: [(2R,3S,5R,6S)-5-phenylmethoxy-2-(2-phenylsulfanylethynyl)-6-prop-2-enyloxan-3-yl] acetate Traditional Name: acetic acid [(2R,3S,5R,6S)-6-allyl-5-benzoxy-2-[2-(phenylthio)ethynyl]tetrahydropyran-3-yl] ester Formula: C25H26O4S MolecularWeight: 422.53654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(C(OC1C#CSC2=CC=CC=C2)CC=C)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)O[C@H]1C[C@H]([C@@H](O[C@@H]1C#CSC2=CC=CC=C2)CC=C)OCC3=CC=CC=C3

InChI

InChI=1S/C25H26O4S/c1-3-10-22-24(27-18-20-11-6-4-7-12-20)17-25(28-19(2)26)23(29-22)15-16-30-21-13-8-5-9-14-21/h3-9,11-14,22-25H,1,10,17-18H2,2H3/t22-,23+,24+,25-/m0/s1