N-[[2-(4-methanidylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]methanesulfonamide

Systemtic Name: N-[[2-(4-methanidylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]methanesulfonamide Openeye Name: N-[[2-(4-methanidylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]methanesulfonamide CAS Name: N-[[2-(4-methanidyl-1-piperazin-4-iumyl)-3-pyridinyl]methyl]methanesulfonamide IUPAC Name: N-[[2-(4-methanidylpiperazin-4-ium-1-yl)pyridin-3-yl]methyl]methanesulfonamide Traditional Name: N-[[2-(4-methanidylpiperazin-4-ium-1-yl)-3-pyridyl]methyl]methanesulfonamide Formula: C12H20N4O2S MolecularWeight: 284.3778

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1=C(N=CC=C1)N2CC[NH+](CC2)[CH2-]

Isomeric SMILES

CS(=O)(=O)NCC1=C(N=CC=C1)N2CC[NH+](CC2)[CH2-]

InChI

InChI=1S/C12H20N4O2S/c1-15-6-8-16(9-7-15)12-11(4-3-5-13-12)10-14-19(2,17)18/h3-5,14-15H,1,6-10H2,2H3