[(2R,4R,6R)-2-oxidanyl-2-[(4R)-2-oxidanylidene-1,3-thiazolidin-4-yl]-6-phenethyl-oxan-4-yl] 3-methylbut-2-enoate

Systemtic Name: [(2R,4R,6R)-2-oxidanyl-2-[(4R)-2-oxidanylidene-1,3-thiazolidin-4-yl]-6-phenethyl-oxan-4-yl] 3-methylbut-2-enoate Openeye Name: [(2R,4R,6R)-2-hydroxy-2-[(4R)-2-oxothiazolidin-4-yl]-6-phenethyl-tetrahydropyran-4-yl] 3-methylbut-2-enoate CAS Name: 3-methyl-2-butenoic acid [(2R,4R,6R)-2-hydroxy-2-[(4R)-2-oxo-4-thiazolidinyl]-6-phenethyl-4-oxanyl] ester IUPAC Name: [(2R,4R,6R)-2-hydroxy-2-[(4R)-2-oxo-1,3-thiazolidin-4-yl]-6-phenethyloxan-4-yl] 3-methylbut-2-enoate Traditional Name: 3-methylbut-2-enoic acid [(2R,4R,6R)-2-hydroxy-2-[(4R)-2-ketothiazolidin-4-yl]-6-phenethyl-tetrahydropyran-4-yl] ester Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OC1CC(OC(C1)(C2CSC(=O)N2)O)CCC3=CC=CC=C3)C

Isomeric SMILES

CC(=CC(=O)O[C@@H]1C[C@H](O[C@](C1)([C@@H]2CSC(=O)N2)O)CCC3=CC=CC=C3)C

InChI

InChI=1S/C21H27NO5S/c1-14(2)10-19(23)26-17-11-16(9-8-15-6-4-3-5-7-15)27-21(25,12-17)18-13-28-20(24)22-18/h3-7,10,16-18,25H,8-9,11-13H2,1-2H3,(H,22,24)/t16-,17-,18+,21-/m1/s1