3-(phenylsulfonyl)-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine

Systemtic Name: 3-(phenylsulfonyl)-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine Openeye Name: 3-(benzenesulfonyl)-1-[2-(isopropylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine CAS Name: 3-(benzenesulfonyl)-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propylphenyl]piperazine IUPAC Name: 3-(benzenesulfonyl)-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propylphenyl]piperazine Traditional Name: 3-besyl-1-[2-(isopropylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine Formula: C22H31N3O6S3 MolecularWeight: 529.69304

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C(C)C)N2CCNC(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C(C)C)N2CCNC(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H31N3O6S3/c1-4-8-18-11-12-20(24-34(30,31)33(28,29)17(2)3)21(15-18)25-14-13-23-22(16-25)32(26,27)19-9-6-5-7-10-19/h5-7,9-12,15,17,22-24H,4,8,13-14,16H2,1-3H3