N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-6-[2,2,2-tris(fluoranyl)ethoxy]pyridine-3-carboxamide

Systemtic Name: N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-6-[2,2,2-tris(fluoranyl)ethoxy]pyridine-3-carboxamide Openeye Name: N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide CAS Name: N-[3-[[3-(1-imidazolyl)-1-oxopropyl]amino]phenyl]-6-(2,2,2-trifluoroethoxy)-3-pyridinecarboxamide IUPAC Name: N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide Traditional Name: N-[3-(3-imidazol-1-ylpropanoylamino)phenyl]-6-(2,2,2-trifluoroethoxy)nicotinamide Formula: C20H18F3N5O3 MolecularWeight: 433.38383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCN2C=CN=C2)NC(=O)C3=CN=C(C=C3)OCC(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCN2C=CN=C2)NC(=O)C3=CN=C(C=C3)OCC(F)(F)F

InChI

InChI=1S/C20H18F3N5O3/c21-20(22,23)12-31-18-5-4-14(11-25-18)19(30)27-16-3-1-2-15(10-16)26-17(29)6-8-28-9-7-24-13-28/h1-5,7,9-11,13H,6,8,12H2,(H,26,29)(H,27,30)