2-(4-methoxyphenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide

Systemtic Name: 2-(4-methoxyphenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-(4-methoxyphenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide CAS Name: 2-[(4-methoxyphenyl)thio]-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(4-methoxyphenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[(4-methoxyphenyl)thio]-N-[4-nitro-2-(trifluoromethyl)phenyl]propionamide Formula: C17H15F3N2O4S MolecularWeight: 400.37221

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F)SC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])C(F)(F)F)SC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H15F3N2O4S/c1-10(27-13-6-4-12(26-2)5-7-13)16(23)21-15-8-3-11(22(24)25)9-14(15)17(18,19)20/h3-10H,1-2H3,(H,21,23)