2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methyl-pentanoic acid

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methyl-pentanoic acid Openeye Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methyl-pentanoic acid CAS Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methylpentanoic acid IUPAC Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methylpentanoic acid Traditional Name: 4-methyl-2-(piazthiol-4-ylsulfonylamino)valeric acid Formula: C12H15N3O4S2 MolecularWeight: 329.3952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=CC2=NSN=C21

Isomeric SMILES

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=CC2=NSN=C21

InChI

InChI=1S/C12H15N3O4S2/c1-7(2)6-9(12(16)17)15-21(18,19)10-5-3-4-8-11(10)14-20-13-8/h3-5,7,9,15H,6H2,1-2H3,(H,16,17)