2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethanethiol

Systemtic Name: 2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethanethiol Openeye Name: 2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethanethiol CAS Name: 2-[4-[3-(trifluoromethylthio)phenyl]-1-piperazinyl]ethanethiol IUPAC Name: 2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethanethiol Traditional Name: 2-[4-[3-(trifluoromethylthio)phenyl]piperazino]ethanethiol Formula: C13H17F3N2S2 MolecularWeight: 322.41269

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCS)C2=CC(=CC=C2)SC(F)(F)F

Isomeric SMILES

C1CN(CCN1CCS)C2=CC(=CC=C2)SC(F)(F)F

InChI

InChI=1S/C13H17F3N2S2/c14-13(15,16)20-12-3-1-2-11(10-12)18-6-4-17(5-7-18)8-9-19/h1-3,10,19H,4-9H2