N-(5-bromanylpyridin-2-yl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(5-bromo-2-pyridyl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(5-bromo-2-pyridinyl)-2-(4-methylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(5-bromo-2-pyridyl)-2-(4-mesylpiperazin-1-ium-1-yl)acetamide Formula: C12H18BrN4O3S+ MolecularWeight: 378.26532

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=NC=C(C=C2)Br

Isomeric SMILES

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=NC=C(C=C2)Br

InChI

InChI=1S/C12H17BrN4O3S/c1-21(19,20)17-6-4-16(5-7-17)9-12(18)15-11-3-2-10(13)8-14-11/h2-3,8H,4-7,9H2,1H3,(H,14,15,18)/p+1