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

Systemtic Name: (2-methylsulfanylpyridin-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (2-methylsulfanyl-3-pyridyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: [2-(methylthio)-3-pyridinyl]-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (2-methylsulfanylpyridin-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: [2-(methylthio)-3-pyridyl]-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone Formula: C18H18F3N3OS MolecularWeight: 381.41523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18F3N3OS/c1-26-16-15(6-3-7-22-16)17(25)24-10-8-23(9-11-24)14-5-2-4-13(12-14)18(19,20)21/h2-7,12H,8-11H2,1H3