2-naphthalen-2-ylsulfanyl-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone

Systemtic Name: 2-naphthalen-2-ylsulfanyl-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone Openeye Name: 2-(2-naphthylsulfanyl)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]ethanone CAS Name: 2-(2-naphthalenylthio)-1-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]ethanone IUPAC Name: 2-naphthalen-2-ylsulfanyl-1-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethanone Traditional Name: 2-(2-naphthylthio)-1-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]ethanone Formula: C22H20F3N3OS MolecularWeight: 431.47391

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H20F3N3OS/c23-22(24,25)18-6-8-20(26-14-18)27-9-11-28(12-10-27)21(29)15-30-19-7-5-16-3-1-2-4-17(16)13-19/h1-8,13-14H,9-12,15H2