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4-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]butanenitrile
4-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]butanenitrile
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Descriptors Computed from Structure
Canonical SMILES:
C1CN(CCN1CCCC#N)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F
Isomeric SMILES
C1CN(CCN1CCCC#N)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F
InChI
InChI=1S/C15H18F3N3O2S/c16-15(17,18)13-4-3-5-14(12-13)24(22,23)21-10-8-20(9-11-21)7-2-1-6-19/h3-5,12H,1-2,7-11H2
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- [(1R)-2-(aminocarbonylamino)-2-oxidanylidene-1-phenyl-ethyl]-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]methyl]-propyl-azanium
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