2-(3-cyano-4-fluoranyl-phenyl)-N-(2-fluoranyl-4-iodanyl-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 2-(3-cyano-4-fluoranyl-phenyl)-N-(2-fluoranyl-4-iodanyl-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 2-(3-cyano-4-fluoro-phenyl)-N-(2-fluoro-4-iodo-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 2-(3-cyano-4-fluorophenyl)-N-(2-fluoro-4-iodophenyl)-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 2-(3-cyano-4-fluorophenyl)-N-(2-fluoro-4-iodophenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 2-(3-cyano-4-fluoro-phenyl)-N-(2-fluoro-4-iodo-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C18H8F5IN4O MolecularWeight: 518.178806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N2C(=CC(=N2)C(F)(F)F)C(=O)NC3=C(C=C(C=C3)I)F)C#N)F

Isomeric SMILES

C1=CC(=C(C=C1N2C(=CC(=N2)C(F)(F)F)C(=O)NC3=C(C=C(C=C3)I)F)C#N)F

InChI

InChI=1S/C18H8F5IN4O/c19-12-3-2-11(5-9(12)8-25)28-15(7-16(27-28)18(21,22)23)17(29)26-14-4-1-10(24)6-13(14)20/h1-7H,(H,26,29)