2-[3-(methylsulfonylaminocarbamoyl)pyridin-1-ium-1-yl]-N-propan-2-yl-ethanamide chloride

Systemtic Name: 2-[3-(methylsulfonylaminocarbamoyl)pyridin-1-ium-1-yl]-N-propan-2-yl-ethanamide chloride Openeye Name: N-isopropyl-2-[3-(methanesulfonamidocarbamoyl)pyridin-1-ium-1-yl]acetamide chloride CAS Name: 2-[3-[(methylsulfonylhydrazo)-oxomethyl]-1-pyridin-1-iumyl]-N-propan-2-ylacetamide chloride IUPAC Name: 2-[3-(methanesulfonamidocarbamoyl)pyridin-1-ium-1-yl]-N-propan-2-ylacetamide chloride Traditional Name: N-isopropyl-2-[3-(methanesulfonamidocarbamoyl)pyridin-1-ium-1-yl]acetamide chloride Formula: C12H19ClN4O4S MolecularWeight: 350.82166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[N+]1=CC=CC(=C1)C(=O)NNS(=O)(=O)C.[Cl-]

Isomeric SMILES

CC(C)NC(=O)C[N+]1=CC=CC(=C1)C(=O)NNS(=O)(=O)C.[Cl-]

InChI

InChI=1S/C12H18N4O4S.ClH/c1-9(2)13-11(17)8-16-6-4-5-10(7-16)12(18)14-15-21(3,19)20;/h4-7,9,15H,8H2,1-3H3,(H-,13,14,17,18);1H