ethyl (4S,5R)-5-methyl-4-(2-phenylsulfanylpent-4-enoyl)-1,3-oxazolidine-3-carboxylate

Systemtic Name: ethyl (4S,5R)-5-methyl-4-(2-phenylsulfanylpent-4-enoyl)-1,3-oxazolidine-3-carboxylate Openeye Name: ethyl (4S,5R)-5-methyl-4-(2-phenylsulfanylpent-4-enoyl)oxazolidine-3-carboxylate CAS Name: (4S,5R)-5-methyl-4-[1-oxo-2-(phenylthio)pent-4-enyl]-3-oxazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (4S,5R)-5-methyl-4-(2-phenylsulfanylpent-4-enoyl)-1,3-oxazolidine-3-carboxylate Traditional Name: (4S,5R)-5-methyl-4-[2-(phenylthio)pent-4-enoyl]oxazolidine-3-carboxylic acid ethyl ester Formula: C18H23NO4S MolecularWeight: 349.44452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1COC(C1C(=O)C(CC=C)SC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)N1CO[C@@H]([C@H]1C(=O)C(CC=C)SC2=CC=CC=C2)C

InChI

InChI=1S/C18H23NO4S/c1-4-9-15(24-14-10-7-6-8-11-14)17(20)16-13(3)23-12-19(16)18(21)22-5-2/h4,6-8,10-11,13,15-16H,1,5,9,12H2,2-3H3/t13-,15?,16+/m1/s1