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2-fluoranyl-6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]benzenecarbonitrile

2-fluoranyl-6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name:2-fluoranyl-6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]benzenecarbonitrile
Openeye Name:2-fluoro-6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]benzonitrile
CAS Name:2-fluoro-6-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]benzonitrile
IUPAC Name:2-fluoro-6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]benzonitrile
Traditional Name:2-fluoro-6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]benzonitrile
Formula: C18H15F4N3O2S
MolecularWeight: 413.389213
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F


Isomeric SMILES

C1CN(CCN1C2=C(C(=CC=C2)F)C#N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F


InChI

InChI=1S/C18H15F4N3O2S/c19-16-5-2-6-17(15(16)12-23)24-7-9-25(10-8-24)28(26,27)14-4-1-3-13(11-14)18(20,21)22/h1-6,11H,7-10H2


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