3-tert-butyl-1-(phenylmethyl)-N-[3-(trifluoromethyl)phenyl]pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-1-(phenylmethyl)-N-[3-(trifluoromethyl)phenyl]pyrazole-4-sulfonamide Openeye Name: 1-benzyl-3-tert-butyl-N-[3-(trifluoromethyl)phenyl]pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-1-(phenylmethyl)-N-[3-(trifluoromethyl)phenyl]-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-3-tert-butyl-N-[3-(trifluoromethyl)phenyl]pyrazole-4-sulfonamide Traditional Name: 1-benzyl-3-tert-butyl-N-[3-(trifluoromethyl)phenyl]pyrazole-4-sulfonamide Formula: C21H22F3N3O2S MolecularWeight: 437.47849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=C1S(=O)(=O)NC2=CC=CC(=C2)C(F)(F)F)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C=C1S(=O)(=O)NC2=CC=CC(=C2)C(F)(F)F)CC3=CC=CC=C3

InChI

InChI=1S/C21H22F3N3O2S/c1-20(2,3)19-18(14-27(25-19)13-15-8-5-4-6-9-15)30(28,29)26-17-11-7-10-16(12-17)21(22,23)24/h4-12,14,26H,13H2,1-3H3