(2S)-3-phenylmethoxy-2-[[(3R)-1,1,4-tris(oxidanylidene)-2-[[2-(trifluoromethyl)phenyl]methyl]-1,2,5-thiadiazolidin-3-yl]amino]propanoic acid

Systemtic Name: (2S)-3-phenylmethoxy-2-[[(3R)-1,1,4-tris(oxidanylidene)-2-[[2-(trifluoromethyl)phenyl]methyl]-1,2,5-thiadiazolidin-3-yl]amino]propanoic acid Openeye Name: (2S)-3-benzyloxy-2-[[(3R)-1,1,4-trioxo-2-[[2-(trifluoromethyl)phenyl]methyl]-1,2,5-thiadiazolidin-3-yl]amino]propanoic acid CAS Name: (2S)-3-phenylmethoxy-2-[[(3R)-1,1,4-trioxo-2-[[2-(trifluoromethyl)phenyl]methyl]-1,2,5-thiadiazolidin-3-yl]amino]propanoic acid IUPAC Name: (2S)-3-phenylmethoxy-2-[[(3R)-1,1,4-trioxo-2-[[2-(trifluoromethyl)phenyl]methyl]-1,2,5-thiadiazolidin-3-yl]amino]propanoic acid Traditional Name: (2S)-3-benzoxy-2-[[(3R)-1,1,4-triketo-2-[2-(trifluoromethyl)benzyl]-1,2,5-thiadiazolidin-3-yl]amino]propionic acid Formula: C20H20F3N3O6S MolecularWeight: 487.44951

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(C(=O)O)NC2C(=O)NS(=O)(=O)N2CC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)COC[C@@H](C(=O)O)N[C@H]2C(=O)NS(=O)(=O)N2CC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H20F3N3O6S/c21-20(22,23)15-9-5-4-8-14(15)10-26-17(18(27)25-33(26,30)31)24-16(19(28)29)12-32-11-13-6-2-1-3-7-13/h1-9,16-17,24H,10-12H2,(H,25,27)(H,28,29)/t16-,17+/m0/s1