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

Systemtic Name: 2-[3-fluoranyl-4-(methylsulfonylamino)phenyl]-N-[[2-pyrimidin-2-yl-4-(trifluoromethyl)phenyl]methyl]propanamide Openeye Name: 2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-pyrimidin-2-yl-4-(trifluoromethyl)phenyl]methyl]propanamide CAS Name: 2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-(2-pyrimidinyl)-4-(trifluoromethyl)phenyl]methyl]propanamide IUPAC Name: 2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-pyrimidin-2-yl-4-(trifluoromethyl)phenyl]methyl]propanamide Traditional Name: 2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[2-(2-pyrimidyl)-4-(trifluoromethyl)benzyl]propionamide Formula: C22H20F4N4O3S MolecularWeight: 496.477813

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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)C3=NC=CC=N3

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)C3=NC=CC=N3

InChI

InChI=1S/C22H20F4N4O3S/c1-13(14-5-7-19(18(23)10-14)30-34(2,32)33)21(31)29-12-15-4-6-16(22(24,25)26)11-17(15)20-27-8-3-9-28-20/h3-11,13,30H,12H2,1-2H3,(H,29,31)