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

Systemtic Name: (2-phenylsulfanylpyridin-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (2-phenylsulfanyl-3-pyridyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: [2-(phenylthio)-3-pyridinyl]-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (2-phenylsulfanylpyridin-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: [2-(phenylthio)-3-pyridyl]-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone Formula: C23H20F3N3OS MolecularWeight: 443.48461

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C23H20F3N3OS/c24-23(25,26)17-6-4-7-18(16-17)28-12-14-29(15-13-28)22(30)20-10-5-11-27-21(20)31-19-8-2-1-3-9-19/h1-11,16H,12-15H2