1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-[(4-tert-butylphenyl)methyl]piperazine Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-4-(4-tert-butylbenzyl)piperazine Formula: C23H26F6N2O2S MolecularWeight: 508.520159

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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)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)C(F)(F)F

InChI

InChI=1S/C23H26F6N2O2S/c1-21(2,3)17-6-4-16(5-7-17)15-30-8-10-31(11-9-30)34(32,33)20-13-18(22(24,25)26)12-19(14-20)23(27,28)29/h4-7,12-14H,8-11,15H2,1-3H3