1-[2-methoxy-5-(3-methylpiperidin-1-yl)sulfonyl-phenyl]-4-[4-(2-methylbutan-2-yl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-[2-methoxy-5-(3-methylpiperidin-1-yl)sulfonyl-phenyl]-4-[4-(2-methylbutan-2-yl)phenyl]sulfonyl-piperazine Openeye Name: 1-[4-(1,1-dimethylpropyl)phenyl]sulfonyl-4-[2-methoxy-5-[(3-methyl-1-piperidyl)sulfonyl]phenyl]piperazine CAS Name: 1-[2-methoxy-5-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazine IUPAC Name: 1-[2-methoxy-5-(3-methylpiperidin-1-yl)sulfonylphenyl]-4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazine Traditional Name: 1-(4-tert-amylphenyl)sulfonyl-4-[2-methoxy-5-(3-methylpiperidino)sulfonyl-phenyl]piperazine Formula: C28H41N3O5S2 MolecularWeight: 563.77224

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC(C4)C)OC

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC(C4)C)OC

InChI

InChI=1S/C28H41N3O5S2/c1-6-28(3,4)23-9-11-24(12-10-23)37(32,33)30-18-16-29(17-19-30)26-20-25(13-14-27(26)36-5)38(34,35)31-15-7-8-22(2)21-31/h9-14,20,22H,6-8,15-19,21H2,1-5H3