N-(4-fluoranyl-3-nitro-phenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]acetamide CAS Name: N-(4-fluoro-3-nitrophenyl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]acetamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylacetamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]acetamide Formula: C14H9F4N3O3S MolecularWeight: 375.298173

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CSC2=NC=C(C=C2)C(F)(F)F)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CSC2=NC=C(C=C2)C(F)(F)F)[N+](=O)[O-])F

InChI

InChI=1S/C14H9F4N3O3S/c15-10-3-2-9(5-11(10)21(23)24)20-12(22)7-25-13-4-1-8(6-19-13)14(16,17)18/h1-6H,7H2,(H,20,22)