N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-3,5-bis(trifluoromethyl)benzamide

Systemtic Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-3,5-bis(trifluoromethyl)benzamide Openeye Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-3,5-bis(trifluoromethyl)benzamide CAS Name: N-[4-cyano-2-(4-methyl-2-quinolinyl)-3-pyrazolyl]-3,5-bis(trifluoromethyl)benzamide IUPAC Name: N-[4-cyano-2-(4-methylquinolin-2-yl)pyrazol-3-yl]-3,5-bis(trifluoromethyl)benzamide Traditional Name: N-[4-cyano-2-(4-methyl-2-quinolyl)pyrazol-3-yl]-3,5-bis(trifluoromethyl)benzamide Formula: C23H13F6N5O MolecularWeight: 489.372639

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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(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C23H13F6N5O/c1-12-6-19(32-18-5-3-2-4-17(12)18)34-20(14(10-30)11-31-34)33-21(35)13-7-15(22(24,25)26)9-16(8-13)23(27,28)29/h2-9,11H,1H3,(H,33,35)