N-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-[4-(4-ethanoylphenyl)piperazin-1-yl]-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxo-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-[4-(4-acetylphenyl)-1-piperazinyl]-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-[4-(4-acetylphenyl)piperazin-1-yl]-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-[4-(4-acetylphenyl)piperazino]-2-keto-1-phenyl-ethyl]piazthiole-4-sulfonamide Formula: C26H25N5O4S2 MolecularWeight: 535.6378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C26H25N5O4S2/c1-18(32)19-10-12-21(13-11-19)30-14-16-31(17-15-30)26(33)24(20-6-3-2-4-7-20)29-37(34,35)23-9-5-8-22-25(23)28-36-27-22/h2-13,24,29H,14-17H2,1H3