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

Systemtic Name: 2-(4-fluorophenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Openeye Name: 2-(4-fluorophenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide CAS Name: 2-[(4-fluorophenyl)thio]-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide IUPAC Name: 2-(4-fluorophenyl)sulfanyl-N-[4-nitro-2-(trifluoromethyl)phenyl]propanamide Traditional Name: 2-[(4-fluorophenyl)thio]-N-[4-nitro-2-(trifluoromethyl)phenyl]propionamide Formula: C16H12F4N2O3S MolecularWeight: 388.336693

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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)F

Isomeric SMILES

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

InChI

InChI=1S/C16H12F4N2O3S/c1-9(26-12-5-2-10(17)3-6-12)15(23)21-14-7-4-11(22(24)25)8-13(14)16(18,19)20/h2-9H,1H3,(H,21,23)