N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-6-(trifluoromethyl)pyridine-3-carboxamide

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-6-(trifluoromethyl)pyridine-3-carboxamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-6-(trifluoromethyl)pyridine-3-carboxamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-6-(trifluoromethyl)-3-pyridinecarboxamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-6-(trifluoromethyl)pyridine-3-carboxamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-6-(trifluoromethyl)nicotinamide Formula: C20H17F3N6O MolecularWeight: 414.38379

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC(=O)C3=CN=C(C=C3)C(F)(F)F)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC(=O)C3=CN=C(C=C3)C(F)(F)F)C#N)N

InChI

InChI=1S/C20H17F3N6O/c21-20(22,23)17-9-8-13(12-27-17)19(30)26-10-4-7-16-15(11-24)18(25)29(28-16)14-5-2-1-3-6-14/h1-3,5-6,8-9,12H,4,7,10,25H2,(H,26,30)