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

Systemtic Name: 2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]propanenitrile hydrochloride Openeye Name: 2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]propanenitrile hydrochloride CAS Name: 2-[4-[3-(trifluoromethylthio)phenyl]-1-piperazinyl]propanenitrile hydrochloride IUPAC Name: 2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]propanenitrile hydrochloride Traditional Name: 2-[4-[3-(trifluoromethylthio)phenyl]piperazino]propionitrile hydrochloride Formula: C14H17ClF3N3S MolecularWeight: 351.81809

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)N1CCN(CC1)C2=CC(=CC=C2)SC(F)(F)F.Cl

Isomeric SMILES

CC(C#N)N1CCN(CC1)C2=CC(=CC=C2)SC(F)(F)F.Cl

InChI

InChI=1S/C14H16F3N3S.ClH/c1-11(10-18)19-5-7-20(8-6-19)12-3-2-4-13(9-12)21-14(15,16)17;/h2-4,9,11H,5-8H2,1H3;1H