2-[3-(4-tert-butylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethanamide

Systemtic Name: 2-[3-(4-tert-butylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethanamide Openeye Name: 2-[3-(4-tert-butylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]acetamide CAS Name: 2-[3-(4-tert-butylphenyl)-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]acetamide IUPAC Name: 2-[3-(4-tert-butylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]acetamide Traditional Name: 2-[3-(4-tert-butylphenyl)-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]acetamide Formula: C22H22F3N3O MolecularWeight: 401.42479

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN(C=C2CC(=O)N)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN(C=C2CC(=O)N)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C22H22F3N3O/c1-21(2,3)16-9-7-14(8-10-16)20-15(11-19(26)29)13-28(27-20)18-6-4-5-17(12-18)22(23,24)25/h4-10,12-13H,11H2,1-3H3,(H2,26,29)