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

Systemtic Name: N-[1-[4-(2-fluorophenyl)piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[1-benzyl-2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxo-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[1-[4-(2-fluorophenyl)-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[1-[4-(2-fluorophenyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[1-benzyl-2-[4-(2-fluorophenyl)piperazino]-2-keto-ethyl]piazthiole-4-sulfonamide Formula: C25H24FN5O3S2 MolecularWeight: 525.618163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2F)C(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2F)C(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C25H24FN5O3S2/c26-19-9-4-5-11-22(19)30-13-15-31(16-14-30)25(32)21(17-18-7-2-1-3-8-18)29-36(33,34)23-12-6-10-20-24(23)28-35-27-20/h1-12,21,29H,13-17H2