N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-(trifluoromethyl)benzamide Openeye Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-4-(trifluoromethyl)benzamide CAS Name: N-[4-cyano-2-(4-methyl-2-quinolinyl)-3-pyrazolyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-4-(trifluoromethyl)benzamide Traditional Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-4-(trifluoromethyl)benzamide Formula: C22H14F3N5O MolecularWeight: 421.37467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C#N)NC(=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H14F3N5O/c1-13-10-19(28-18-5-3-2-4-17(13)18)30-20(15(11-26)12-27-30)29-21(31)14-6-8-16(9-7-14)22(23,24)25/h2-10,12H,1H3,(H,29,31)