1-(4-tert-butylphenyl)sulfonyl-2,2-dimethyl-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-2,2-dimethyl-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-2,2-dimethyl-4-[3-(trifluoromethyl)-2-pyridyl]piperazine CAS Name: 1-(4-tert-butylphenyl)sulfonyl-2,2-dimethyl-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-2,2-dimethyl-4-[3-(trifluoromethyl)pyridin-2-yl]piperazine Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-2,2-dimethyl-4-[3-(trifluoromethyl)-2-pyridyl]piperazine Formula: C22H28F3N3O2S MolecularWeight: 455.53683

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)C3=C(C=CC=N3)C(F)(F)F)C

Isomeric SMILES

CC1(CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)C3=C(C=CC=N3)C(F)(F)F)C

InChI

InChI=1S/C22H28F3N3O2S/c1-20(2,3)16-8-10-17(11-9-16)31(29,30)28-14-13-27(15-21(28,4)5)19-18(22(23,24)25)7-6-12-26-19/h6-12H,13-15H2,1-5H3