2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-(piazthiol-4-ylsulfonylamino)propionic acid Formula: C12H11N5O4S2 MolecularWeight: 353.37684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC(CC3=CN=CN3)C(=O)O

Isomeric SMILES

C1=CC2=NSN=C2C(=C1)S(=O)(=O)NC(CC3=CN=CN3)C(=O)O

InChI

InChI=1S/C12H11N5O4S2/c18-12(19)9(4-7-5-13-6-14-7)17-23(20,21)10-3-1-2-8-11(10)16-22-15-8/h1-3,5-6,9,17H,4H2,(H,13,14)(H,18,19)