2-[3-(methylsulfamoylamino)-2-oxidanylidene-6-phenyl-1-[1,1,1-tris(fluoranyl)-4-methyl-2-oxidanylidene-pentan-3-yl]pyridin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[3-(methylsulfamoylamino)-2-oxidanylidene-6-phenyl-1-[1,1,1-tris(fluoranyl)-4-methyl-2-oxidanylidene-pentan-3-yl]pyridin-1-ium-1-yl]ethanamide Openeye Name: 2-[3-(methylsulfamoylamino)-2-oxo-6-phenyl-1-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)pyridin-1-ium-1-yl]acetamide CAS Name: 2-[3-(methylsulfamoylamino)-2-oxo-6-phenyl-1-(1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl)-1-pyridin-1-iumyl]acetamide IUPAC Name: 2-[3-(methylsulfamoylamino)-2-oxo-6-phenyl-1-(1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl)pyridin-1-ium-1-yl]acetamide Traditional Name: 2-[2-keto-3-(methylsulfamoylamino)-6-phenyl-1-(3,3,3-trifluoro-1-isopropyl-2-keto-propyl)pyridin-1-ium-1-yl]acetamide Formula: C20H24F3N4O5S+ MolecularWeight: 489.48857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(F)(F)F)[N+]1(C(=CC=C(C1=O)NS(=O)(=O)NC)C2=CC=CC=C2)CC(=O)N

Isomeric SMILES

CC(C)C(C(=O)C(F)(F)F)[N+]1(C(=CC=C(C1=O)NS(=O)(=O)NC)C2=CC=CC=C2)CC(=O)N

InChI

InChI=1S/C20H23F3N4O5S/c1-12(2)17(18(29)20(21,22)23)27(11-16(24)28)15(13-7-5-4-6-8-13)10-9-14(19(27)30)26-33(31,32)25-3/h4-10,12,17,25-26H,11H2,1-3H3,(H-,24,28)/p+1