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

Systemtic Name: N-[1-oxidanylidene-3-phenyl-1-(4-phenylpiperazin-1-yl)propan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[1-benzyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[1-oxo-3-phenyl-1-(4-phenyl-1-piperazinyl)propan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[1-oxo-3-phenyl-1-(4-phenylpiperazin-1-yl)propan-2-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[1-benzyl-2-keto-2-(4-phenylpiperazino)ethyl]piazthiole-4-sulfonamide Formula: C25H25N5O3S2 MolecularWeight: 507.6277

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N5O3S2/c31-25(30-16-14-29(15-17-30)20-10-5-2-6-11-20)22(18-19-8-3-1-4-9-19)28-35(32,33)23-13-7-12-21-24(23)27-34-26-21/h1-13,22,28H,14-18H2