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4-methyl-2-(4-methylphenyl)-6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]pyrimidine
4-methyl-2-(4-methylphenyl)-6-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]pyrimidine
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC=C(C=C1)C2=NC(=CC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F)C
Isomeric SMILES
CC1=CC=C(C=C1)C2=NC(=CC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F)C
InChI
InChI=1S/C23H23F3N4O2S/c1-16-6-8-18(9-7-16)22-27-17(2)14-21(28-22)29-10-12-30(13-11-29)33(31,32)20-5-3-4-19(15-20)23(24,25)26/h3-9,14-15H,10-13H2,1-2H3
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