N-[2-(3-methylsulfanylpiperazin-1-yl)-2-[4-(phenylmethyl)phenyl]ethyl]benzenesulfonamide

Systemtic Name: N-[2-(3-methylsulfanylpiperazin-1-yl)-2-[4-(phenylmethyl)phenyl]ethyl]benzenesulfonamide Openeye Name: N-[2-(4-benzylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethyl]benzenesulfonamide CAS Name: N-[2-[3-(methylthio)-1-piperazinyl]-2-[4-(phenylmethyl)phenyl]ethyl]benzenesulfonamide IUPAC Name: N-[2-(4-benzylphenyl)-2-(3-methylsulfanylpiperazin-1-yl)ethyl]benzenesulfonamide Traditional Name: N-[2-(4-benzylphenyl)-2-[3-(methylthio)piperazino]ethyl]benzenesulfonamide Formula: C26H31N3O2S2 MolecularWeight: 481.67324

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Descriptors Computed from Structure

Canonical SMILES:

CSC1CN(CCN1)C(CNS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=CC=C4

Isomeric SMILES

CSC1CN(CCN1)C(CNS(=O)(=O)C2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H31N3O2S2/c1-32-26-20-29(17-16-27-26)25(19-28-33(30,31)24-10-6-3-7-11-24)23-14-12-22(13-15-23)18-21-8-4-2-5-9-21/h2-15,25-28H,16-20H2,1H3