N-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylethyl]ethanamide

Systemtic Name: N-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylethyl]ethanamide Openeye Name: N-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylethyl]acetamide CAS Name: N-[2-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]sulfonyl]ethyl]acetamide IUPAC Name: N-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylethyl]acetamide Traditional Name: N-[2-(4-pyridin-1-ium-2-ylpiperazino)sulfonylethyl]acetamide Formula: C13H21N4O3S+ MolecularWeight: 313.39584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=[NH+]2

Isomeric SMILES

CC(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=[NH+]2

InChI

InChI=1S/C13H20N4O3S/c1-12(18)14-6-11-21(19,20)17-9-7-16(8-10-17)13-4-2-3-5-15-13/h2-5H,6-11H2,1H3,(H,14,18)/p+1