N-(5-bromanylquinolin-8-yl)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]ethanamide

Systemtic Name: N-(5-bromanylquinolin-8-yl)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]ethanamide Openeye Name: N-(5-bromo-8-quinolyl)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide CAS Name: N-(5-bromo-8-quinolinyl)-2-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]acetamide IUPAC Name: N-(5-bromoquinolin-8-yl)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide Traditional Name: N-(5-bromo-8-quinolyl)-2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetamide Formula: C16H12BrF3N4O MolecularWeight: 413.19189

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3)C(F)(F)F

Isomeric SMILES

CC1=CC(=NN1CC(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3)C(F)(F)F

InChI

InChI=1S/C16H12BrF3N4O/c1-9-7-13(16(18,19)20)23-24(9)8-14(25)22-12-5-4-11(17)10-3-2-6-21-15(10)12/h2-7H,8H2,1H3,(H,22,25)