1-(3-cyclohexylsulfonyl-3-pyridin-2-yl-propyl)-4-(2-methoxyphenyl)piperazine

Systemtic Name: 1-(3-cyclohexylsulfonyl-3-pyridin-2-yl-propyl)-4-(2-methoxyphenyl)piperazine Openeye Name: 1-[3-cyclohexylsulfonyl-3-(2-pyridyl)propyl]-4-(2-methoxyphenyl)piperazine CAS Name: 1-[3-cyclohexylsulfonyl-3-(2-pyridinyl)propyl]-4-(2-methoxyphenyl)piperazine IUPAC Name: 1-(3-cyclohexylsulfonyl-3-pyridin-2-ylpropyl)-4-(2-methoxyphenyl)piperazine Traditional Name: 1-[3-cyclohexylsulfonyl-3-(2-pyridyl)propyl]-4-(2-methoxyphenyl)piperazine Formula: C25H35N3O3S MolecularWeight: 457.6287

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCC(C3=CC=CC=N3)S(=O)(=O)C4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCC(C3=CC=CC=N3)S(=O)(=O)C4CCCCC4

InChI

InChI=1S/C25H35N3O3S/c1-31-24-13-6-5-12-23(24)28-19-17-27(18-20-28)16-14-25(22-11-7-8-15-26-22)32(29,30)21-9-3-2-4-10-21/h5-8,11-13,15,21,25H,2-4,9-10,14,16-20H2,1H3