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

Systemtic Name: 1-[5-(2-hydroxyphenyl)-2-(phenoxysulfonylsulfonylamino)phenyl]-3-methylsulfanyl-piperazine Openeye Name: 1-[5-(2-hydroxyphenyl)-2-(phenoxysulfonylsulfonylamino)phenyl]-3-methylsulfanyl-piperazine CAS Name: 1-[5-(2-hydroxyphenyl)-2-(phenoxysulfonylsulfonylamino)phenyl]-3-(methylthio)piperazine IUPAC Name: 1-[5-(2-hydroxyphenyl)-2-(phenoxysulfonylsulfonylamino)phenyl]-3-methylsulfanylpiperazine Traditional Name: 1-[5-(2-hydroxyphenyl)-2-(phenoxysulfonylsulfonylamino)phenyl]-3-(methylthio)piperazine Formula: C23H25N3O6S3 MolecularWeight: 535.6561

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Descriptors Computed from Structure

Canonical SMILES:

CSC1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CSC1CN(CCN1)C2=C(C=CC(=C2)C3=CC=CC=C3O)NS(=O)(=O)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O6S3/c1-33-23-16-26(14-13-24-23)21-15-17(19-9-5-6-10-22(19)27)11-12-20(21)25-34(28,29)35(30,31)32-18-7-3-2-4-8-18/h2-12,15,23-25,27H,13-14,16H2,1H3