1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-pyridin-2-ylsulfanyl-ethanone

Systemtic Name: 1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-pyridin-2-ylsulfanyl-ethanone Openeye Name: 1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-(2-pyridylsulfanyl)ethanone CAS Name: 1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-2-(2-pyridinylthio)ethanone IUPAC Name: 1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-2-pyridin-2-ylsulfanylethanone Traditional Name: 1-[4-(3-nitrophenyl)sulfonylpiperazino]-2-(2-pyridylthio)ethanone Formula: C17H18N4O5S2 MolecularWeight: 422.47862

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=CC=CC=N2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=CC=CC=N2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O5S2/c22-17(13-27-16-6-1-2-7-18-16)19-8-10-20(11-9-19)28(25,26)15-5-3-4-14(12-15)21(23)24/h1-7,12H,8-11,13H2