methyl (4R,5S,6R)-4,5,6-tris(phenylmethoxy)-6-[(2R)-3-pyridin-2-ylsulfanyloxiran-2-yl]hexanoate

Systemtic Name: methyl (4R,5S,6R)-4,5,6-tris(phenylmethoxy)-6-[(2R)-3-pyridin-2-ylsulfanyloxiran-2-yl]hexanoate Openeye Name: methyl (4R,5S,6R)-4,5,6-tribenzyloxy-6-[(2R)-3-(2-pyridylsulfanyl)oxiran-2-yl]hexanoate CAS Name: (4R,5S,6R)-4,5,6-tris(phenylmethoxy)-6-[(2R)-3-(2-pyridinylthio)-2-oxiranyl]hexanoic acid methyl ester IUPAC Name: methyl (4R,5S,6R)-4,5,6-tris(phenylmethoxy)-6-[(2R)-3-pyridin-2-ylsulfanyloxiran-2-yl]hexanoate Traditional Name: (4R,5S,6R)-4,5,6-tribenzoxy-6-[(2R)-3-(2-pyridylthio)oxiran-2-yl]hexanoic acid methyl ester Formula: C35H37NO6S MolecularWeight: 599.73638

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(C(C1C(O1)SC2=CC=CC=N2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

COC(=O)CC[C@H]([C@@H]([C@H]([C@@H]1C(O1)SC2=CC=CC=N2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C35H37NO6S/c1-38-31(37)21-20-29(39-23-26-13-5-2-6-14-26)32(40-24-27-15-7-3-8-16-27)33(41-25-28-17-9-4-10-18-28)34-35(42-34)43-30-19-11-12-22-36-30/h2-19,22,29,32-35H,20-21,23-25H2,1H3/t29-,32+,33-,34-,35?/m1/s1