4-[2-(1,2,5-thiadiazol-3-ylcarbonylamino)ethyl]benzoic acid

Systemtic Name: 4-[2-(1,2,5-thiadiazol-3-ylcarbonylamino)ethyl]benzoic acid Openeye Name: 4-[2-(1,2,5-thiadiazole-3-carbonylamino)ethyl]benzoic acid CAS Name: 4-[2-[[oxo(1,2,5-thiadiazol-3-yl)methyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-(1,2,5-thiadiazole-3-carbonylamino)ethyl]benzoic acid Traditional Name: 4-[2-(1,2,5-thiadiazole-3-carbonylamino)ethyl]benzoic acid Formula: C12H11N3O3S MolecularWeight: 277.29904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)C2=NSN=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)C2=NSN=C2)C(=O)O

InChI

InChI=1S/C12H11N3O3S/c16-11(10-7-14-19-15-10)13-6-5-8-1-3-9(4-2-8)12(17)18/h1-4,7H,5-6H2,(H,13,16)(H,17,18)