5-[2-(2-azanylpyrimidin-5-yl)ethynyl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide

Systemtic Name: 5-[2-(2-azanylpyrimidin-5-yl)ethynyl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Openeye Name: 5-[2-(2-aminopyrimidin-5-yl)ethynyl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide CAS Name: 5-[2-(2-amino-5-pyrimidinyl)ethynyl]-N-[3-(trifluoromethyl)phenyl]-3-pyridinecarboxamide IUPAC Name: 5-[2-(2-aminopyrimidin-5-yl)ethynyl]-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide Traditional Name: 5-[2-(2-aminopyrimidin-5-yl)ethynyl]-N-[3-(trifluoromethyl)phenyl]nicotinamide Formula: C19H12F3N5O MolecularWeight: 383.32669

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CN=CC(=C2)C#CC3=CN=C(N=C3)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CN=CC(=C2)C#CC3=CN=C(N=C3)N)C(F)(F)F

InChI

InChI=1S/C19H12F3N5O/c20-19(21,22)15-2-1-3-16(7-15)27-17(28)14-6-12(8-24-11-14)4-5-13-9-25-18(23)26-10-13/h1-3,6-11H,(H,27,28)(H2,23,25,26)