2-(4-nitrophenyl)sulfanyl-N-[[2-(trifluoromethyloxy)phenyl]methyl]propanamide

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-N-[[2-(trifluoromethyloxy)phenyl]methyl]propanamide Openeye Name: 2-(4-nitrophenyl)sulfanyl-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide CAS Name: 2-[(4-nitrophenyl)thio]-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide IUPAC Name: 2-(4-nitrophenyl)sulfanyl-N-[[2-(trifluoromethoxy)phenyl]methyl]propanamide Traditional Name: 2-[(4-nitrophenyl)thio]-N-[2-(trifluoromethoxy)benzyl]propionamide Formula: C17H15F3N2O4S MolecularWeight: 400.37221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1OC(F)(F)F)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1OC(F)(F)F)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H15F3N2O4S/c1-11(27-14-8-6-13(7-9-14)22(24)25)16(23)21-10-12-4-2-3-5-15(12)26-17(18,19)20/h2-9,11H,10H2,1H3,(H,21,23)