N-(4-bromanyl-2-fluoranyl-phenyl)-2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-(3-cyanophenyl)-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C18H9BrF4N4O MolecularWeight: 453.187873

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=CC(=N2)C(F)(F)F)C(=O)NC3=C(C=C(C=C3)Br)F)C#N

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=CC(=N2)C(F)(F)F)C(=O)NC3=C(C=C(C=C3)Br)F)C#N

InChI

InChI=1S/C18H9BrF4N4O/c19-11-4-5-14(13(20)7-11)25-17(28)15-8-16(18(21,22)23)26-27(15)12-3-1-2-10(6-12)9-24/h1-8H,(H,25,28)