N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanamide

Systemtic Name: N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanamide Openeye Name: N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanamide CAS Name: N-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanamide IUPAC Name: N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanamide Traditional Name: N-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]-3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propionamide Formula: C20H24F3N4O3S+ MolecularWeight: 457.48977

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC(=O)CCNS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC(=O)CCNS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H23F3N4O3S/c21-20(22,23)16-4-3-5-17(13-16)31(29,30)26-9-7-19(28)25-14-15-6-8-24-18(12-15)27-10-1-2-11-27/h3-6,8,12-13,26H,1-2,7,9-11,14H2,(H,25,28)/p+1