3-tert-butyl-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-phenyl-pyrazole-4-sulfonamide

Systemtic Name: 3-tert-butyl-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-phenyl-pyrazole-4-sulfonamide Openeye Name: 3-tert-butyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-phenyl-pyrazole-4-sulfonamide CAS Name: 3-tert-butyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-phenyl-4-pyrazolesulfonamide IUPAC Name: 3-tert-butyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-phenylpyrazole-4-sulfonamide Traditional Name: 3-tert-butyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-1-phenyl-pyrazole-4-sulfonamide Formula: C20H19ClF3N3O2S MolecularWeight: 457.89697

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClF3N3O2S/c1-19(2,3)18-17(12-27(25-18)14-7-5-4-6-8-14)30(28,29)26-16-11-13(20(22,23)24)9-10-15(16)21/h4-12,26H,1-3H3