1-(4-pyridin-2-ylpiperazin-1-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-pyridin-2-ylpiperazin-1-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone Openeye Name: 1-[4-(2-pyridyl)piperazin-1-yl]-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-[4-(2-pyridinyl)-1-piperazinyl]-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-(4-pyridin-2-ylpiperazin-1-yl)-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanone Traditional Name: 1-[4-(2-pyridyl)piperazino]-2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethanone Formula: C17H17F3N4OS MolecularWeight: 382.40329

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H17F3N4OS/c18-17(19,20)13-4-5-15(22-11-13)26-12-16(25)24-9-7-23(8-10-24)14-3-1-2-6-21-14/h1-6,11H,7-10,12H2