S-ethyl 2-[(2R,4R,5S,6S)-4-oxidanyl-6-phenyl-5-phenylmethoxy-oxan-2-yl]ethanethioate

Systemtic Name: S-ethyl 2-[(2R,4R,5S,6S)-4-oxidanyl-6-phenyl-5-phenylmethoxy-oxan-2-yl]ethanethioate Openeye Name: S-ethyl 2-[(2R,4R,5S,6S)-5-benzyloxy-4-hydroxy-6-phenyl-tetrahydropyran-2-yl]ethanethioate CAS Name: 2-[(2R,4R,5S,6S)-4-hydroxy-6-phenyl-5-phenylmethoxy-2-oxanyl]ethanethioic acid S-ethyl ester IUPAC Name: S-ethyl 2-[(2R,4R,5S,6S)-4-hydroxy-6-phenyl-5-phenylmethoxyoxan-2-yl]ethanethioate Traditional Name: 2-[(2R,4R,5S,6S)-5-benzoxy-4-hydroxy-6-phenyl-tetrahydropyran-2-yl]ethanethioic acid S-ethyl ester Formula: C22H26O4S MolecularWeight: 386.50444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)CC1CC(C(C(O1)C2=CC=CC=C2)OCC3=CC=CC=C3)O

Isomeric SMILES

CCSC(=O)C[C@H]1C[C@H]([C@@H]([C@@H](O1)C2=CC=CC=C2)OCC3=CC=CC=C3)O

InChI

InChI=1S/C22H26O4S/c1-2-27-20(24)14-18-13-19(23)22(25-15-16-9-5-3-6-10-16)21(26-18)17-11-7-4-8-12-17/h3-12,18-19,21-23H,2,13-15H2,1H3/t18-,19-,21+,22+/m1/s1