(1-tert-butyl-5-propan-2-yl-pyrazol-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (1-tert-butyl-5-propan-2-yl-pyrazol-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (1-tert-butyl-5-isopropyl-pyrazol-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (1-tert-butyl-5-propan-2-yl-3-pyrazolyl)-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (1-tert-butyl-5-propan-2-ylpyrazol-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (1-tert-butyl-5-isopropyl-pyrazol-3-yl)-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone Formula: C22H29F3N4O MolecularWeight: 422.48707

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NN1C(C)(C)C)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC(=NN1C(C)(C)C)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H29F3N4O/c1-15(2)19-14-18(26-29(19)21(3,4)5)20(30)28-11-9-27(10-12-28)17-8-6-7-16(13-17)22(23,24)25/h6-8,13-15H,9-12H2,1-5H3