1-(3-nitrophenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(3-nitrophenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone Openeye Name: 1-(3-nitrophenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-(3-nitrophenyl)-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-(3-nitrophenyl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanone Traditional Name: 1-(3-nitrophenyl)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethanone Formula: C14H9F3N2O3S MolecularWeight: 342.29307

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9F3N2O3S/c15-14(16,17)10-4-5-13(18-7-10)23-8-12(20)9-2-1-3-11(6-9)19(21)22/h1-7H,8H2