N,N-diethyl-2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N,N-diethyl-2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanyl-ethanamide Openeye Name: N,N-diethyl-2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanyl-acetamide CAS Name: N,N-diethyl-2-[[2-nitro-4-(trifluoromethylsulfonyl)phenyl]thio]acetamide IUPAC Name: N,N-diethyl-2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanylacetamide Traditional Name: N,N-diethyl-2-[(2-nitro-4-triflyl-phenyl)thio]acetamide Formula: C13H15F3N2O5S2 MolecularWeight: 400.39381

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=C(C=C(C=C1)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)CSC1=C(C=C(C=C1)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H15F3N2O5S2/c1-3-17(4-2)12(19)8-24-11-6-5-9(7-10(11)18(20)21)25(22,23)13(14,15)16/h5-7H,3-4,8H2,1-2H3