N-(2-cyano-4-nitro-phenyl)-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-2-[3-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-2-[3-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-(2-cyano-4-nitrophenyl)-2-[[3-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-2-[3-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-2-[[3-(trifluoromethyl)phenyl]thio]acetamide Formula: C16H10F3N3O3S MolecularWeight: 381.32911

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)SCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C(F)(F)F

InChI

InChI=1S/C16H10F3N3O3S/c17-16(18,19)11-2-1-3-13(7-11)26-9-15(23)21-14-5-4-12(22(24)25)6-10(14)8-20/h1-7H,9H2,(H,21,23)