3-[5-[5-bromanyl-1-(carboxymethyl)-2-oxidanylidene-indol-3-ylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 3-[5-[5-bromanyl-1-(carboxymethyl)-2-oxidanylidene-indol-3-ylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 3-[5-[5-bromo-1-(carboxymethyl)-2-oxo-indolin-3-ylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 3-[5-[5-bromo-1-(carboxymethyl)-2-oxo-3-indolylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 3-[5-[5-bromo-1-(carboxymethyl)-2-oxoindol-3-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 3-[5-[5-bromo-1-(carboxymethyl)-2-keto-indolin-3-ylidene]-4-keto-2-thioxo-thiazolidin-3-yl]propionic acid Formula: C16H11BrN2O6S2 MolecularWeight: 471.30234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=C3C(=O)N(C(=S)S3)CCC(=O)O)C(=O)N2CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=C3C(=O)N(C(=S)S3)CCC(=O)O)C(=O)N2CC(=O)O

InChI

InChI=1S/C16H11BrN2O6S2/c17-7-1-2-9-8(5-7)12(14(24)19(9)6-11(22)23)13-15(25)18(16(26)27-13)4-3-10(20)21/h1-2,5H,3-4,6H2,(H,20,21)(H,22,23)