N-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide

Systemtic Name: N-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]methanesulfonamide Openeye Name: N-[2-[4-(6-nitro-3-pyridyl)piperazin-1-yl]-2-oxo-ethyl]methanesulfonamide CAS Name: N-[2-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-2-oxoethyl]methanesulfonamide IUPAC Name: N-[2-[4-(6-nitropyridin-3-yl)piperazin-1-yl]-2-oxoethyl]methanesulfonamide Traditional Name: N-[2-keto-2-[4-(6-nitro-3-pyridyl)piperazino]ethyl]methanesulfonamide Formula: C12H17N5O5S MolecularWeight: 343.35888

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC(=O)N1CCN(CC1)C2=CN=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)NCC(=O)N1CCN(CC1)C2=CN=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H17N5O5S/c1-23(21,22)14-9-12(18)16-6-4-15(5-7-16)10-2-3-11(13-8-10)17(19)20/h2-3,8,14H,4-7,9H2,1H3