5-[2-[3-(furan-2-ylcarbonylamino)phenyl]sulfanylethanoylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-[3-(furan-2-ylcarbonylamino)phenyl]sulfanylethanoylamino]-2-oxidanyl-benzoic acid Openeye Name: 5-[[2-[3-(furan-2-carbonylamino)phenyl]sulfanylacetyl]amino]-2-hydroxy-benzoic acid CAS Name: 5-[[2-[[3-[[2-furanyl(oxo)methyl]amino]phenyl]thio]-1-oxoethyl]amino]-2-hydroxybenzoic acid IUPAC Name: 5-[[2-[3-(furan-2-carbonylamino)phenyl]sulfanylacetyl]amino]-2-hydroxybenzoic acid Traditional Name: 5-[[2-[[3-(2-furoylamino)phenyl]thio]acetyl]amino]-2-hydroxy-benzoic acid Formula: C20H16N2O6S MolecularWeight: 412.41584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SCC(=O)NC2=CC(=C(C=C2)O)C(=O)O)NC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC(=CC(=C1)SCC(=O)NC2=CC(=C(C=C2)O)C(=O)O)NC(=O)C3=CC=CO3

InChI

InChI=1S/C20H16N2O6S/c23-16-7-6-13(10-15(16)20(26)27)21-18(24)11-29-14-4-1-3-12(9-14)22-19(25)17-5-2-8-28-17/h1-10,23H,11H2,(H,21,24)(H,22,25)(H,26,27)