1-cyclopentyl-4-[5-[4-(phenylsulfonyl)phenyl]pyridin-2-yl]piperazine dihydrochloride

Systemtic Name: 1-cyclopentyl-4-[5-[4-(phenylsulfonyl)phenyl]pyridin-2-yl]piperazine dihydrochloride Openeye Name: 1-[5-[4-(benzenesulfonyl)phenyl]-2-pyridyl]-4-cyclopentyl-piperazine dihydrochloride CAS Name: 1-[5-[4-(benzenesulfonyl)phenyl]-2-pyridinyl]-4-cyclopentylpiperazine dihydrochloride IUPAC Name: 1-[5-[4-(benzenesulfonyl)phenyl]pyridin-2-yl]-4-cyclopentylpiperazine dihydrochloride Traditional Name: 1-[5-(4-besylphenyl)-2-pyridyl]-4-cyclopentyl-piperazine dihydrochloride Formula: C26H31Cl2N3O2S MolecularWeight: 520.51424

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CCN(CC2)C3=NC=C(C=C3)C4=CC=C(C=C4)S(=O)(=O)C5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1CCC(C1)N2CCN(CC2)C3=NC=C(C=C3)C4=CC=C(C=C4)S(=O)(=O)C5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C26H29N3O2S.2ClH/c30-32(31,24-8-2-1-3-9-24)25-13-10-21(11-14-25)22-12-15-26(27-20-22)29-18-16-28(17-19-29)23-6-4-5-7-23;;/h1-3,8-15,20,23H,4-7,16-19H2;2*1H