6-methyl-4-[4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazin-1-yl]-2-(trifluoromethyl)quinoline

Systemtic Name: 6-methyl-4-[4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazin-1-yl]-2-(trifluoromethyl)quinoline Openeye Name: 4-[4-[4-(1,1-dimethylpropyl)phenyl]sulfonylpiperazin-1-yl]-6-methyl-2-(trifluoromethyl)quinoline CAS Name: 6-methyl-4-[4-[4-(2-methylbutan-2-yl)phenyl]sulfonyl-1-piperazinyl]-2-(trifluoromethyl)quinoline IUPAC Name: 6-methyl-4-[4-[4-(2-methylbutan-2-yl)phenyl]sulfonylpiperazin-1-yl]-2-(trifluoromethyl)quinoline Traditional Name: 4-[4-(4-tert-amylphenyl)sulfonylpiperazino]-6-methyl-2-(trifluoromethyl)quinoline Formula: C26H30F3N3O2S MolecularWeight: 505.59551

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=NC4=C3C=C(C=C4)C)C(F)(F)F

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=NC4=C3C=C(C=C4)C)C(F)(F)F

InChI

InChI=1S/C26H30F3N3O2S/c1-5-25(3,4)19-7-9-20(10-8-19)35(33,34)32-14-12-31(13-15-32)23-17-24(26(27,28)29)30-22-11-6-18(2)16-21(22)23/h6-11,16-17H,5,12-15H2,1-4H3