(phenylmethyl) 2-[(2S,4S,5R)-5-(diethylcarbamothioyloxymethyl)-4-phenylmethoxy-oxolan-2-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[(2S,4S,5R)-5-(diethylcarbamothioyloxymethyl)-4-phenylmethoxy-oxolan-2-yl]ethanoate Openeye Name: benzyl 2-[(2S,4S,5R)-4-benzyloxy-5-(diethylcarbamothioyloxymethyl)tetrahydrofuran-2-yl]acetate CAS Name: 2-[(2S,4S,5R)-5-[[diethylamino(sulfanylidene)methoxy]methyl]-4-phenylmethoxy-2-oxolanyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(2S,4S,5R)-5-(diethylcarbamothioyloxymethyl)-4-phenylmethoxyoxolan-2-yl]acetate Traditional Name: 2-[(2S,4S,5R)-4-benzoxy-5-(diethylthiocarbamoyloxymethyl)tetrahydrofuran-2-yl]acetic acid benzyl ester Formula: C26H33NO5S MolecularWeight: 471.60892

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)OCC1C(CC(O1)CC(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=S)OC[C@@H]1[C@H](C[C@H](O1)CC(=O)OCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C26H33NO5S/c1-3-27(4-2)26(33)31-19-24-23(29-17-20-11-7-5-8-12-20)15-22(32-24)16-25(28)30-18-21-13-9-6-10-14-21/h5-14,22-24H,3-4,15-19H2,1-2H3/t22-,23-,24+/m0/s1