3-[3-[4-[(E)-4,4-bis(fluoranyl)-3-oxidanyl-4-phenyl-but-1-enyl]-2-oxidanylidene-1,3-thiazolidin-3-yl]propylsulfanyl]propanoic acid

Systemtic Name: 3-[3-[4-[(E)-4,4-bis(fluoranyl)-3-oxidanyl-4-phenyl-but-1-enyl]-2-oxidanylidene-1,3-thiazolidin-3-yl]propylsulfanyl]propanoic acid Openeye Name: 3-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenyl-but-1-enyl]-2-oxo-thiazolidin-3-yl]propylsulfanyl]propanoic acid CAS Name: 3-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenylbut-1-enyl]-2-oxo-3-thiazolidinyl]propylthio]propanoic acid IUPAC Name: 3-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenylbut-1-enyl]-2-oxo-1,3-thiazolidin-3-yl]propylsulfanyl]propanoic acid Traditional Name: 3-[3-[4-[(E)-4,4-difluoro-3-hydroxy-4-phenyl-but-1-enyl]-2-keto-thiazolidin-3-yl]propylthio]propionic acid Formula: C19H23F2NO4S2 MolecularWeight: 431.517026

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(=O)S1)CCCSCCC(=O)O)C=CC(C(C2=CC=CC=C2)(F)F)O

Isomeric SMILES

C1C(N(C(=O)S1)CCCSCCC(=O)O)/C=C/C(C(C2=CC=CC=C2)(F)F)O

InChI

InChI=1S/C19H23F2NO4S2/c20-19(21,14-5-2-1-3-6-14)16(23)8-7-15-13-28-18(26)22(15)10-4-11-27-12-9-17(24)25/h1-3,5-8,15-16,23H,4,9-13H2,(H,24,25)/b8-7+