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

Systemtic Name: N-[1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[1-benzyl-2-[4-(3-chlorophenyl)piperazin-1-yl]-2-oxo-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[1-[4-(3-chlorophenyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[1-benzyl-2-[4-(3-chlorophenyl)piperazino]-2-keto-ethyl]piazthiole-4-sulfonamide Formula: C25H24ClN5O3S2 MolecularWeight: 542.07276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C25H24ClN5O3S2/c26-19-8-4-9-20(17-19)30-12-14-31(15-13-30)25(32)22(16-18-6-2-1-3-7-18)29-36(33,34)23-11-5-10-21-24(23)28-35-27-21/h1-11,17,22,29H,12-16H2