N-[(4-bromophenyl)methyl]-N,1-dimethyl-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[(4-bromophenyl)methyl]-N,1-dimethyl-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[(4-bromophenyl)methyl]-N,1-dimethyl-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[(4-bromophenyl)methyl]-N,1-dimethyl-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[(4-bromophenyl)methyl]-N,1-dimethyl-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(4-bromobenzyl)-N,1-dimethyl-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C14H13BrF3N3O MolecularWeight: 376.17173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)N(C)CC2=CC=C(C=C2)Br)C(F)(F)F

Isomeric SMILES

CN1C(=C(C=N1)C(=O)N(C)CC2=CC=C(C=C2)Br)C(F)(F)F

InChI

InChI=1S/C14H13BrF3N3O/c1-20(8-9-3-5-10(15)6-4-9)13(22)11-7-19-21(2)12(11)14(16,17)18/h3-7H,8H2,1-2H3