1-[2-(methylsulfanylsulfonylamino)-5-(phenylsulfonyl)phenyl]-3-(phenylmethyl)piperazine

Systemtic Name: 1-[2-(methylsulfanylsulfonylamino)-5-(phenylsulfonyl)phenyl]-3-(phenylmethyl)piperazine Openeye Name: 1-[5-(benzenesulfonyl)-2-(methylsulfanylsulfonylamino)phenyl]-3-benzyl-piperazine CAS Name: 1-[5-(benzenesulfonyl)-2-[(methylthio)sulfonylamino]phenyl]-3-(phenylmethyl)piperazine IUPAC Name: 1-[5-(benzenesulfonyl)-2-(methylsulfanylsulfonylamino)phenyl]-3-benzylpiperazine Traditional Name: 3-benzyl-1-[5-besyl-2-[(methylthio)sulfonylamino]phenyl]piperazine Formula: C24H27N3O4S3 MolecularWeight: 517.68388

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Descriptors Computed from Structure

Canonical SMILES:

CSS(=O)(=O)NC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

Isomeric SMILES

CSS(=O)(=O)NC1=C(C=C(C=C1)S(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O4S3/c1-32-34(30,31)26-23-13-12-22(33(28,29)21-10-6-3-7-11-21)17-24(23)27-15-14-25-20(18-27)16-19-8-4-2-5-9-19/h2-13,17,20,25-26H,14-16,18H2,1H3