1-[(4-pyrazol-1-ylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-[(4-pyrazol-1-ylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine Openeye Name: 1-[(4-pyrazol-1-ylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine CAS Name: 1-[[4-(1-pyrazolyl)phenyl]methyl]-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine IUPAC Name: 1-[(4-pyrazol-1-ylphenyl)methyl]-4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine Traditional Name: 1-(4-pyrazol-1-ylbenzyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-piperazine Formula: C21H21F3N4O2S MolecularWeight: 450.47725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)N3C=CC=N3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)N3C=CC=N3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H21F3N4O2S/c22-21(23,24)18-3-1-4-20(15-18)31(29,30)27-13-11-26(12-14-27)16-17-5-7-19(8-6-17)28-10-2-9-25-28/h1-10,15H,11-14,16H2