1-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-4-(3-methylsulfonylphenyl)carbonyl-piperazin-2-one

Systemtic Name: 1-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-4-(3-methylsulfonylphenyl)carbonyl-piperazin-2-one Openeye Name: 1-[4-[(1-cyclopentyl-4-piperidyl)oxy]phenyl]-4-(3-methylsulfonylbenzoyl)piperazin-2-one CAS Name: 1-[4-[(1-cyclopentyl-4-piperidinyl)oxy]phenyl]-4-[(3-methylsulfonylphenyl)-oxomethyl]-2-piperazinone IUPAC Name: 1-[4-(1-cyclopentylpiperidin-4-yl)oxyphenyl]-4-(3-methylsulfonylbenzoyl)piperazin-2-one Traditional Name: 1-[4-[(1-cyclopentyl-4-piperidyl)oxy]phenyl]-4-(3-mesylbenzoyl)piperazin-2-one Formula: C28H35N3O5S MolecularWeight: 525.6596

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(C(=O)C2)C3=CC=C(C=C3)OC4CCN(CC4)C5CCCC5

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(C(=O)C2)C3=CC=C(C=C3)OC4CCN(CC4)C5CCCC5

InChI

InChI=1S/C28H35N3O5S/c1-37(34,35)26-8-4-5-21(19-26)28(33)30-17-18-31(27(32)20-30)23-9-11-24(12-10-23)36-25-13-15-29(16-14-25)22-6-2-3-7-22/h4-5,8-12,19,22,25H,2-3,6-7,13-18,20H2,1H3