1-[[1-[(4-methylphenyl)sulfonylmethyl]-1,2,3,4-tetrazol-5-yl]-[3-(trifluoromethyl)phenyl]methyl]-4-phenyl-piperazine

Systemtic Name: 1-[[1-[(4-methylphenyl)sulfonylmethyl]-1,2,3,4-tetrazol-5-yl]-[3-(trifluoromethyl)phenyl]methyl]-4-phenyl-piperazine Openeye Name: 1-phenyl-4-[[1-(p-tolylsulfonylmethyl)tetrazol-5-yl]-[3-(trifluoromethyl)phenyl]methyl]piperazine CAS Name: 1-[[1-[(4-methylphenyl)sulfonylmethyl]-5-tetrazolyl]-[3-(trifluoromethyl)phenyl]methyl]-4-phenylpiperazine IUPAC Name: 1-[[1-[(4-methylphenyl)sulfonylmethyl]tetrazol-5-yl]-[3-(trifluoromethyl)phenyl]methyl]-4-phenylpiperazine Traditional Name: 1-phenyl-4-[[1-(tosylmethyl)tetrazol-5-yl]-[3-(trifluoromethyl)phenyl]methyl]piperazine Formula: C27H27F3N6O2S MolecularWeight: 556.60249

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CN2C(=NN=N2)C(C3=CC(=CC=C3)C(F)(F)F)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CN2C(=NN=N2)C(C3=CC(=CC=C3)C(F)(F)F)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H27F3N6O2S/c1-20-10-12-24(13-11-20)39(37,38)19-36-26(31-32-33-36)25(21-6-5-7-22(18-21)27(28,29)30)35-16-14-34(15-17-35)23-8-3-2-4-9-23/h2-13,18,25H,14-17,19H2,1H3