3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-piperidin-1-ylcarbonyl-benzoic acid

Systemtic Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-piperidin-1-ylcarbonyl-benzoic acid Openeye Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-(piperidine-1-carbonyl)benzoic acid CAS Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-[oxo(1-piperidinyl)methyl]benzoic acid IUPAC Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-4-(piperidine-1-carbonyl)benzoic acid Traditional Name: 3-(piazthiol-4-ylsulfonylamino)-4-(piperidine-1-carbonyl)benzoic acid Formula: C19H18N4O5S2 MolecularWeight: 446.50002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CCN(CC1)C(=O)C2=C(C=C(C=C2)C(=O)O)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C19H18N4O5S2/c24-18(23-9-2-1-3-10-23)13-8-7-12(19(25)26)11-15(13)22-30(27,28)16-6-4-5-14-17(16)21-29-20-14/h4-8,11,22H,1-3,9-10H2,(H,25,26)