1-tert-butyl-N-[(3-chlorophenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-tert-butyl-N-[(3-chlorophenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-tert-butyl-N-[(3-chlorophenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-tert-butyl-N-[(3-chlorophenyl)methyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-tert-butyl-N-[(3-chlorophenyl)methyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-tert-butyl-N-(3-chlorobenzyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C16H17ClF3N3O MolecularWeight: 359.77389

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=C(C=N1)C(=O)NCC2=CC(=CC=C2)Cl)C(F)(F)F

Isomeric SMILES

CC(C)(C)N1C(=C(C=N1)C(=O)NCC2=CC(=CC=C2)Cl)C(F)(F)F

InChI

InChI=1S/C16H17ClF3N3O/c1-15(2,3)23-13(16(18,19)20)12(9-22-23)14(24)21-8-10-5-4-6-11(17)7-10/h4-7,9H,8H2,1-3H3,(H,21,24)