2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-bromophenyl)-3-phenyl-propanamide

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-bromophenyl)-3-phenyl-propanamide Openeye Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-bromophenyl)-3-phenyl-propanamide CAS Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-bromophenyl)-3-phenylpropanamide IUPAC Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-(4-bromophenyl)-3-phenylpropanamide Traditional Name: N-(4-bromophenyl)-3-phenyl-2-(piazthiol-4-ylsulfonylamino)propionamide Formula: C21H17BrN4O3S2 MolecularWeight: 517.41868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC=C(C=C2)Br)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC2=CC=C(C=C2)Br)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C21H17BrN4O3S2/c22-15-9-11-16(12-10-15)23-21(27)18(13-14-5-2-1-3-6-14)26-31(28,29)19-8-4-7-17-20(19)25-30-24-17/h1-12,18,26H,13H2,(H,23,27)