1-[5-[1-[3-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]pyrazol-1-yl]ethanone

Systemtic Name: 1-[5-[1-[3-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]pyrazol-1-yl]ethanone Openeye Name: 1-[5-[1-[[3-(trifluoromethyl)-2-pyridyl]sulfanyl]ethyl]pyrazol-1-yl]ethanone CAS Name: 1-[5-[1-[[3-(trifluoromethyl)-2-pyridinyl]thio]ethyl]-1-pyrazolyl]ethanone IUPAC Name: 1-[5-[1-[3-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]pyrazol-1-yl]ethanone Traditional Name: 1-[5-[1-[[3-(trifluoromethyl)-2-pyridyl]thio]ethyl]pyrazol-1-yl]ethanone Formula: C13H12F3N3OS MolecularWeight: 315.31409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NN1C(=O)C)SC2=C(C=CC=N2)C(F)(F)F

Isomeric SMILES

CC(C1=CC=NN1C(=O)C)SC2=C(C=CC=N2)C(F)(F)F

InChI

InChI=1S/C13H12F3N3OS/c1-8(11-5-7-18-19(11)9(2)20)21-12-10(13(14,15)16)4-3-6-17-12/h3-8H,1-2H3