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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])Cl

InChI

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