1-[5-ethyl-2-(phenylsulfonylsulfonylamino)phenyl]-3-(phenylmethyl)piperazine

Systemtic Name: 1-[5-ethyl-2-(phenylsulfonylsulfonylamino)phenyl]-3-(phenylmethyl)piperazine Openeye Name: 1-[2-(benzenesulfonylsulfonylamino)-5-ethyl-phenyl]-3-benzyl-piperazine CAS Name: 1-[2-(benzenesulfonylsulfonylamino)-5-ethylphenyl]-3-(phenylmethyl)piperazine IUPAC Name: 1-[2-(benzenesulfonylsulfonylamino)-5-ethylphenyl]-3-benzylpiperazine Traditional Name: 3-benzyl-1-[2-(besylsulfonylamino)-5-ethyl-phenyl]piperazine Formula: C25H29N3O4S2 MolecularWeight: 499.64546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C2=CC=CC=C2)N3CCNC(C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H29N3O4S2/c1-2-20-13-14-24(27-34(31,32)33(29,30)23-11-7-4-8-12-23)25(18-20)28-16-15-26-22(19-28)17-21-9-5-3-6-10-21/h3-14,18,22,26-27H,2,15-17,19H2,1H3