5-[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanoylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanoylamino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]acetyl]amino]benzoic acid CAS Name: 2-hydroxy-5-[[2-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-hydroxy-5-[[2-[(3-methylsulfanyl-1,2,4-thiadiazol-5-yl)sulfanyl]acetyl]amino]benzoic acid Traditional Name: 2-hydroxy-5-[[2-[[3-(methylthio)-1,2,4-thiadiazol-5-yl]thio]acetyl]amino]benzoic acid Formula: C12H11N3O4S3 MolecularWeight: 357.42844

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NSC(=N1)SCC(=O)NC2=CC(=C(C=C2)O)C(=O)O

Isomeric SMILES

CSC1=NSC(=N1)SCC(=O)NC2=CC(=C(C=C2)O)C(=O)O

InChI

InChI=1S/C12H11N3O4S3/c1-20-11-14-12(22-15-11)21-5-9(17)13-6-2-3-8(16)7(4-6)10(18)19/h2-4,16H,5H2,1H3,(H,13,17)(H,18,19)