3-[(5E)-5-[(5-fluoranyl-2-methoxycarbonyl-1H-indol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 3-[(5E)-5-[(5-fluoranyl-2-methoxycarbonyl-1H-indol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[(5E)-5-[(5-fluoro-2-methoxycarbonyl-1H-indol-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[(5E)-5-[(5-fluoro-2-methoxycarbonyl-1H-indol-3-yl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[(5E)-5-[(5-fluoro-2-methoxycarbonyl-1H-indol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[(5E)-5-[(2-carbomethoxy-5-fluoro-1H-indol-3-yl)methylene]-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C17H13FN2O5S2 MolecularWeight: 408.423923

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(N1)C=CC(=C2)F)C=C3C(=O)N(C(=S)S3)CCC(=O)O

Isomeric SMILES

COC(=O)C1=C(C2=C(N1)C=CC(=C2)F)/C=C/3\C(=O)N(C(=S)S3)CCC(=O)O

InChI

InChI=1S/C17H13FN2O5S2/c1-25-16(24)14-10(9-6-8(18)2-3-11(9)19-14)7-12-15(23)20(17(26)27-12)5-4-13(21)22/h2-3,6-7,19H,4-5H2,1H3,(H,21,22)/b12-7+