3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-2-one

Systemtic Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-2-one Openeye Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-2-one CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-4-[[4-(trifluoromethyl)phenyl]methyl]-2-piperazinone IUPAC Name: 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperazin-2-one Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-4-[4-(trifluoromethyl)benzyl]piperazin-2-one Formula: C23H23F3N4O MolecularWeight: 428.45013

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H23F3N4O/c1-15-20(16(2)30(28-15)19-6-4-3-5-7-19)21-22(31)27-12-13-29(21)14-17-8-10-18(11-9-17)23(24,25)26/h3-11,21H,12-14H2,1-2H3,(H,27,31)