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4-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonylbenzenecarbonitrile
4-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonylbenzenecarbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
C1CN(CCN1C(=O)C2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F
Isomeric SMILES
C1CN(CCN1C(=O)C2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C19H16F3N3O3S/c20-19(21,22)16-2-1-3-17(12-16)29(27,28)25-10-8-24(9-11-25)18(26)15-6-4-14(13-23)5-7-15/h1-7,12H,8-11H2
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