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6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]pyridine-3-carbonitrile
6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]pyridine-3-carbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
C1CN(CCN1C2=NC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F
Isomeric SMILES
C1CN(CCN1C2=NC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C17H15F3N4O2S/c18-17(19,20)14-2-1-3-15(10-14)27(25,26)24-8-6-23(7-9-24)16-5-4-13(11-21)12-22-16/h1-5,10,12H,6-9H2
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