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

Systemtic Name: N-methyl-2-(4-nitrophenyl)sulfanyl-N-[[4-(trifluoromethyloxy)phenyl]methyl]propanamide Openeye Name: N-methyl-2-(4-nitrophenyl)sulfanyl-N-[[4-(trifluoromethoxy)phenyl]methyl]propanamide CAS Name: N-methyl-2-[(4-nitrophenyl)thio]-N-[[4-(trifluoromethoxy)phenyl]methyl]propanamide IUPAC Name: N-methyl-2-(4-nitrophenyl)sulfanyl-N-[[4-(trifluoromethoxy)phenyl]methyl]propanamide Traditional Name: N-methyl-2-[(4-nitrophenyl)thio]-N-[4-(trifluoromethoxy)benzyl]propionamide Formula: C18H17F3N2O4S MolecularWeight: 414.39879

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC=C(C=C1)OC(F)(F)F)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N(C)CC1=CC=C(C=C1)OC(F)(F)F)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17F3N2O4S/c1-12(28-16-9-5-14(6-10-16)23(25)26)17(24)22(2)11-13-3-7-15(8-4-13)27-18(19,20)21/h3-10,12H,11H2,1-2H3