3-methylsulfanyl-1-[2-(phenoxysulfonylsulfonylamino)-5-phenyl-phenyl]piperazine

Systemtic Name: 3-methylsulfanyl-1-[2-(phenoxysulfonylsulfonylamino)-5-phenyl-phenyl]piperazine Openeye Name: 3-methylsulfanyl-1-[2-(phenoxysulfonylsulfonylamino)-5-phenyl-phenyl]piperazine CAS Name: 3-(methylthio)-1-[2-(phenoxysulfonylsulfonylamino)-5-phenylphenyl]piperazine IUPAC Name: 3-methylsulfanyl-1-[2-(phenoxysulfonylsulfonylamino)-5-phenylphenyl]piperazine Traditional Name: 3-(methylthio)-1-[2-(phenoxysulfonylsulfonylamino)-5-phenyl-phenyl]piperazine Formula: C23H25N3O5S3 MolecularWeight: 519.6567

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Descriptors Computed from Structure

Canonical SMILES:

CSC1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3)NS(=O)(=O)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CSC1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3)NS(=O)(=O)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O5S3/c1-32-23-17-26(15-14-24-23)22-16-19(18-8-4-2-5-9-18)12-13-21(22)25-33(27,28)34(29,30)31-20-10-6-3-7-11-20/h2-13,16,23-25H,14-15,17H2,1H3