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1-[(4-tert-butylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine
1-[(4-tert-butylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F
Isomeric SMILES
CC(C)(C)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F
InChI
InChI=1S/C22H27F3N2O2S/c1-21(2,3)18-9-7-17(8-10-18)16-26-11-13-27(14-12-26)30(28,29)20-6-4-5-19(15-20)22(23,24)25/h4-10,15H,11-14,16H2,1-3H3
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