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

Systemtic Name: 3-[(5E)-5-[(2-ethoxycarbonyl-5-methoxy-1H-indol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[(5E)-5-[(2-ethoxycarbonyl-5-methoxy-1H-indol-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[(5E)-5-[(2-ethoxycarbonyl-5-methoxy-1H-indol-3-yl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[(5E)-5-[(2-ethoxycarbonyl-5-methoxy-1H-indol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[(5E)-5-[(2-carbethoxy-5-methoxy-1H-indol-3-yl)methylene]-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C19H18N2O6S2 MolecularWeight: 434.48602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)C=C3C(=O)N(C(=S)S3)CCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O6S2/c1-3-27-18(25)16-12(11-8-10(26-2)4-5-13(11)20-16)9-14-17(24)21(19(28)29-14)7-6-15(22)23/h4-5,8-9,20H,3,6-7H2,1-2H3,(H,22,23)/b14-9+