6-[(5E)-5-[(2-methoxycarbonyl-1H-indol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid

Systemtic Name: 6-[(5E)-5-[(2-methoxycarbonyl-1H-indol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Openeye Name: 6-[(5E)-5-[(2-methoxycarbonyl-1H-indol-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoic acid CAS Name: 6-[(5E)-5-[(2-methoxycarbonyl-1H-indol-3-yl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoic acid IUPAC Name: 6-[(5E)-5-[(2-methoxycarbonyl-1H-indol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Traditional Name: 6-[(5E)-5-[(2-carbomethoxy-1H-indol-3-yl)methylene]-4-keto-2-thioxo-thiazolidin-3-yl]hexanoic acid Formula: C20H20N2O5S2 MolecularWeight: 432.5132

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N1)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N1)/C=C/3\C(=O)N(C(=S)S3)CCCCCC(=O)O

InChI

InChI=1S/C20H20N2O5S2/c1-27-19(26)17-13(12-7-4-5-8-14(12)21-17)11-15-18(25)22(20(28)29-15)10-6-2-3-9-16(23)24/h4-5,7-8,11,21H,2-3,6,9-10H2,1H3,(H,23,24)/b15-11+