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

Systemtic Name: 4-[5-[5-bromanyl-1-(carboxymethyl)-2-oxidanylidene-indol-3-ylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Openeye Name: 4-[5-[5-bromo-1-(carboxymethyl)-2-oxo-indolin-3-ylidene]-4-oxo-2-thioxo-thiazolidin-3-yl]butanoic acid CAS Name: 4-[5-[5-bromo-1-(carboxymethyl)-2-oxo-3-indolylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]butanoic acid IUPAC Name: 4-[5-[5-bromo-1-(carboxymethyl)-2-oxoindol-3-ylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoic acid Traditional Name: 4-[5-[5-bromo-1-(carboxymethyl)-2-keto-indolin-3-ylidene]-4-keto-2-thioxo-thiazolidin-3-yl]butyric acid Formula: C17H13BrN2O6S2 MolecularWeight: 485.32892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13BrN2O6S2/c18-8-3-4-10-9(6-8)13(15(25)20(10)7-12(23)24)14-16(26)19(17(27)28-14)5-1-2-11(21)22/h3-4,6H,1-2,5,7H2,(H,21,22)(H,23,24)