2-oxidanyl-5-[[2-phenyl-2-[3-(thiophen-2-ylcarbonylamino)phenyl]sulfanyl-ethanoyl]amino]benzoic acid

Systemtic Name: 2-oxidanyl-5-[[2-phenyl-2-[3-(thiophen-2-ylcarbonylamino)phenyl]sulfanyl-ethanoyl]amino]benzoic acid Openeye Name: 2-hydroxy-5-[[2-phenyl-2-[3-(thiophene-2-carbonylamino)phenyl]sulfanyl-acetyl]amino]benzoic acid CAS Name: 2-hydroxy-5-[[1-oxo-2-[[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]thio]-2-phenylethyl]amino]benzoic acid IUPAC Name: 2-hydroxy-5-[[2-phenyl-2-[3-(thiophene-2-carbonylamino)phenyl]sulfanylacetyl]amino]benzoic acid Traditional Name: 2-hydroxy-5-[[2-phenyl-2-[[3-(2-thenoylamino)phenyl]thio]acetyl]amino]benzoic acid Formula: C26H20N2O5S2 MolecularWeight: 504.5774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)O)C(=O)O)SC3=CC=CC(=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC(=C(C=C2)O)C(=O)O)SC3=CC=CC(=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C26H20N2O5S2/c29-21-12-11-18(15-20(21)26(32)33)28-25(31)23(16-6-2-1-3-7-16)35-19-9-4-8-17(14-19)27-24(30)22-10-5-13-34-22/h1-15,23,29H,(H,27,30)(H,28,31)(H,32,33)