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

Systemtic Name: 1-(2-pyridin-2-ylpyrrolidin-1-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone Openeye Name: 1-[2-(2-pyridyl)pyrrolidin-1-yl]-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-[2-(2-pyridinyl)-1-pyrrolidinyl]-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-(2-pyridin-2-ylpyrrolidin-1-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanone Traditional Name: 1-[2-(2-pyridyl)pyrrolidino]-2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethanone Formula: C17H16F3N3OS MolecularWeight: 367.38865

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CSC2=NC=C(C=C2)C(F)(F)F)C3=CC=CC=N3

Isomeric SMILES

C1CC(N(C1)C(=O)CSC2=NC=C(C=C2)C(F)(F)F)C3=CC=CC=N3

InChI

InChI=1S/C17H16F3N3OS/c18-17(19,20)12-6-7-15(22-10-12)25-11-16(24)23-9-3-5-14(23)13-4-1-2-8-21-13/h1-2,4,6-8,10,14H,3,5,9,11H2