3-(4-tert-butylphenyl)-N-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]-2-methyl-propanethioamide

Systemtic Name: 3-(4-tert-butylphenyl)-N-[[3-fluoranyl-4-(methylsulfonylamino)phenyl]methyl]-2-methyl-propanethioamide Openeye Name: 3-(4-tert-butylphenyl)-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]-2-methyl-propanethioamide CAS Name: 3-(4-tert-butylphenyl)-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]-2-methylpropanethioamide IUPAC Name: 3-(4-tert-butylphenyl)-N-[[3-fluoro-4-(methanesulfonamido)phenyl]methyl]-2-methylpropanethioamide Traditional Name: 3-(4-tert-butylphenyl)-N-[3-fluoro-4-(methanesulfonamido)benzyl]-2-methyl-thiopropionamide Formula: C22H29FN2O2S2 MolecularWeight: 436.606263

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C(C)(C)C)C(=S)NCC2=CC(=C(C=C2)NS(=O)(=O)C)F

Isomeric SMILES

CC(CC1=CC=C(C=C1)C(C)(C)C)C(=S)NCC2=CC(=C(C=C2)NS(=O)(=O)C)F

InChI

InChI=1S/C22H29FN2O2S2/c1-15(12-16-6-9-18(10-7-16)22(2,3)4)21(28)24-14-17-8-11-20(19(23)13-17)25-29(5,26)27/h6-11,13,15,25H,12,14H2,1-5H3,(H,24,28)