5-tert-butyl-N'-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-(phenylmethyl)pyrazole-3-carbohydrazide

Systemtic Name: 5-tert-butyl-N'-[2-chloranyl-5-(trifluoromethyl)phenyl]-2-(phenylmethyl)pyrazole-3-carbohydrazide Openeye Name: 2-benzyl-5-tert-butyl-N'-[2-chloro-5-(trifluoromethyl)phenyl]pyrazole-3-carbohydrazide CAS Name: 5-tert-butyl-N'-[2-chloro-5-(trifluoromethyl)phenyl]-2-(phenylmethyl)-3-pyrazolecarbohydrazide IUPAC Name: 2-benzyl-5-tert-butyl-N'-[2-chloro-5-(trifluoromethyl)phenyl]pyrazole-3-carbohydrazide Traditional Name: 2-benzyl-5-tert-butyl-N'-[2-chloro-5-(trifluoromethyl)phenyl]pyrazole-3-carbohydrazide Formula: C22H22ClF3N4O MolecularWeight: 450.88449

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NNC2=C(C=CC(=C2)C(F)(F)F)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NNC2=C(C=CC(=C2)C(F)(F)F)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H22ClF3N4O/c1-21(2,3)19-12-18(30(29-19)13-14-7-5-4-6-8-14)20(31)28-27-17-11-15(22(24,25)26)9-10-16(17)23/h4-12,27H,13H2,1-3H3,(H,28,31)