2-[(4-chlorophenyl)methylsulfanyl]-N-[4-nitro-2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-[4-nitro-2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-[4-nitro-2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(4-chlorophenyl)methylthio]-N-[4-nitro-2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-[4-nitro-2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(4-chlorobenzyl)thio]-N-[4-nitro-2-(trifluoromethyl)phenyl]acetamide Formula: C16H12ClF3N2O3S MolecularWeight: 404.79129

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=CC=C1CSCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(F)(F)F)Cl

InChI

InChI=1S/C16H12ClF3N2O3S/c17-11-3-1-10(2-4-11)8-26-9-15(23)21-14-6-5-12(22(24)25)7-13(14)16(18,19)20/h1-7H,8-9H2,(H,21,23)