3-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-4-(phenylsulfonyl)piperazin-2-one

Systemtic Name: 3-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-4-(phenylsulfonyl)piperazin-2-one Openeye Name: 4-(benzenesulfonyl)-3-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]piperazin-2-one CAS Name: 4-(benzenesulfonyl)-3-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-2-piperazinone IUPAC Name: 4-(benzenesulfonyl)-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]piperazin-2-one Traditional Name: 4-besyl-3-[2-keto-2-[4-(2-pyridyl)piperazino]ethyl]piperazin-2-one Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)N2CCN(CC2)C3=CC=CC=N3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)N2CCN(CC2)C3=CC=CC=N3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H25N5O4S/c27-20(25-14-12-24(13-15-25)19-8-4-5-9-22-19)16-18-21(28)23-10-11-26(18)31(29,30)17-6-2-1-3-7-17/h1-9,18H,10-16H2,(H,23,28)