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

Systemtic Name: 1-(4-pyridin-2-ylpiperazin-1-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone Openeye Name: 1-[4-(2-pyridyl)piperazin-1-yl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-[4-(2-pyridinyl)-1-piperazinyl]-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-(4-pyridin-2-ylpiperazin-1-yl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanone Traditional Name: 1-[4-(2-pyridyl)piperazino]-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]ethanone Formula: C16H16F3N5OS MolecularWeight: 383.39135

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CSC3=NC=CC(=N3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CSC3=NC=CC(=N3)C(F)(F)F

InChI

InChI=1S/C16H16F3N5OS/c17-16(18,19)12-4-6-21-15(22-12)26-11-14(25)24-9-7-23(8-10-24)13-3-1-2-5-20-13/h1-6H,7-11H2