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

Systemtic Name: N-(5-bromanylquinolin-8-yl)-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide Openeye Name: N-(5-bromo-8-quinolyl)-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide CAS Name: N-(5-bromo-8-quinolinyl)-3-[5-methyl-3-(trifluoromethyl)-1-pyrazolyl]propanamide IUPAC Name: N-(5-bromoquinolin-8-yl)-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propanamide Traditional Name: N-(5-bromo-8-quinolyl)-3-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propionamide Formula: C17H14BrF3N4O MolecularWeight: 427.21847

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3)C(F)(F)F

Isomeric SMILES

CC1=CC(=NN1CCC(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3)C(F)(F)F

InChI

InChI=1S/C17H14BrF3N4O/c1-10-9-14(17(19,20)21)24-25(10)8-6-15(26)23-13-5-4-12(18)11-3-2-7-22-16(11)13/h2-5,7,9H,6,8H2,1H3,(H,23,26)