3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C24H27FN3O4S+ MolecularWeight: 472.552283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCC(C3=CC=CO3)[NH+]4CCCC4)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NC[C@@H](C3=CC=CO3)[NH+]4CCCC4)F

InChI

InChI=1S/C24H26FN3O4S/c1-17-9-10-20(15-21(17)25)33(30,31)27-19-7-4-6-18(14-19)24(29)26-16-22(23-8-5-13-32-23)28-11-2-3-12-28/h4-10,13-15,22,27H,2-3,11-12,16H2,1H3,(H,26,29)/p+1/t22-/m0/s1