(2-methylsulfanylpyridin-3-yl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone

Systemtic Name: (2-methylsulfanylpyridin-3-yl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Openeye Name: (2-methylsulfanyl-3-pyridyl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methanone CAS Name: [2-(methylthio)-3-pyridinyl]-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methanone IUPAC Name: (2-methylsulfanylpyridin-3-yl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Traditional Name: [2-(methylthio)-3-pyridyl]-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]methanone Formula: C17H17F3N4OS MolecularWeight: 382.40329

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CCN(CC2)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H17F3N4OS/c1-26-15-13(3-2-6-21-15)16(25)24-9-7-23(8-10-24)14-5-4-12(11-22-14)17(18,19)20/h2-6,11H,7-10H2,1H3