(2R)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methyl-pentanoate

Systemtic Name: (2R)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methyl-pentanoate Openeye Name: (2R)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methyl-pentanoate CAS Name: (2R)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methylpentanoate IUPAC Name: (2R)-2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-methylpentanoate Traditional Name: (2R)-4-methyl-2-(piazthiol-4-ylsulfonylamino)valerate Formula: C12H14N3O4S2- MolecularWeight: 328.38726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NS(=O)(=O)C1=CC=CC2=NSN=C21

Isomeric SMILES

CC(C)C[C@H](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)/p-1/t9-/m1/s1