2-[3-fluoranyl-4-(methylsulfonylamino)phenyl]-N-[[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]methyl]propanamide

Systemtic Name: 2-[3-fluoranyl-4-(methylsulfonylamino)phenyl]-N-[[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]methyl]propanamide Openeye Name: 2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]methyl]propanamide CAS Name: 2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-(1-pyrrolidinyl)-4-(trifluoromethyl)phenyl]methyl]propanamide IUPAC Name: 2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-pyrrolidin-1-yl-4-(trifluoromethyl)phenyl]methyl]propanamide Traditional Name: 2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[2-pyrrolidino-4-(trifluoromethyl)benzyl]propionamide Formula: C22H25F4N3O3S MolecularWeight: 487.510813

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)NS(=O)(=O)C)F)C(=O)NCC2=C(C=C(C=C2)C(F)(F)F)N3CCCC3

Isomeric SMILES

CC(C1=CC(=C(C=C1)NS(=O)(=O)C)F)C(=O)NCC2=C(C=C(C=C2)C(F)(F)F)N3CCCC3

InChI

InChI=1S/C22H25F4N3O3S/c1-14(15-6-8-19(18(23)11-15)28-33(2,31)32)21(30)27-13-16-5-7-17(22(24,25)26)12-20(16)29-9-3-4-10-29/h5-8,11-12,14,28H,3-4,9-10,13H2,1-2H3,(H,27,30)