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

Systemtic Name: (2-ethylsulfanylpyridin-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (2-ethylsulfanyl-3-pyridyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: [2-(ethylthio)-3-pyridinyl]-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (2-ethylsulfanylpyridin-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: [2-(ethylthio)-3-pyridyl]-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone Formula: C19H20F3N3OS MolecularWeight: 395.44181

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=CC=N1)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCSC1=C(C=CC=N1)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H20F3N3OS/c1-2-27-17-16(7-4-8-23-17)18(26)25-11-9-24(10-12-25)15-6-3-5-14(13-15)19(20,21)22/h3-8,13H,2,9-12H2,1H3