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

Systemtic Name: 3-(2-hydroxyphenyl)-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine Openeye Name: 3-(2-hydroxyphenyl)-1-[2-(isopropylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine CAS Name: 3-(2-hydroxyphenyl)-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propylphenyl]piperazine IUPAC Name: 3-(2-hydroxyphenyl)-1-[2-(propan-2-ylsulfonylsulfonylamino)-5-propylphenyl]piperazine Traditional Name: 3-(2-hydroxyphenyl)-1-[2-(isopropylsulfonylsulfonylamino)-5-propyl-phenyl]piperazine Formula: C22H31N3O5S2 MolecularWeight: 481.62864

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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)C3=CC=CC=C3O

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)S(=O)(=O)C(C)C)N2CCNC(C2)C3=CC=CC=C3O

InChI

InChI=1S/C22H31N3O5S2/c1-4-7-17-10-11-19(24-32(29,30)31(27,28)16(2)3)21(14-17)25-13-12-23-20(15-25)18-8-5-6-9-22(18)26/h5-6,8-11,14,16,20,23-24,26H,4,7,12-13,15H2,1-3H3