3-(3,5-ditert-butylphenyl)-N-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]propanamide

Systemtic Name: 3-(3,5-ditert-butylphenyl)-N-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]propanamide Openeye Name: 3-(3,5-ditert-butylphenyl)-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]propanamide CAS Name: 3-(3,5-ditert-butylphenyl)-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]propanamide IUPAC Name: 3-(3,5-ditert-butylphenyl)-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]propanamide Traditional Name: 3-(3,5-ditert-butylphenyl)-N-[3-fluoro-4-(methanesulfonamido)benzyl]propionamide Formula: C25H35FN2O3S MolecularWeight: 462.620403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35FN2O3S/c1-24(2,3)19-12-17(13-20(15-19)25(4,5)6)9-11-23(29)27-16-18-8-10-22(21(26)14-18)28-32(7,30)31/h8,10,12-15,28H,9,11,16H2,1-7H3,(H,27,29)