2-[3-[bis(fluoranyl)methyl]-5-methyl-pyrazol-1-yl]-N-(5-bromanylquinolin-8-yl)propanamide

Systemtic Name: 2-[3-[bis(fluoranyl)methyl]-5-methyl-pyrazol-1-yl]-N-(5-bromanylquinolin-8-yl)propanamide Openeye Name: N-(5-bromo-8-quinolyl)-2-[3-(difluoromethyl)-5-methyl-pyrazol-1-yl]propanamide CAS Name: N-(5-bromo-8-quinolinyl)-2-[3-(difluoromethyl)-5-methyl-1-pyrazolyl]propanamide IUPAC Name: N-(5-bromoquinolin-8-yl)-2-[3-(difluoromethyl)-5-methylpyrazol-1-yl]propanamide Traditional Name: N-(5-bromo-8-quinolyl)-2-[3-(difluoromethyl)-5-methyl-pyrazol-1-yl]propionamide Formula: C17H15BrF2N4O MolecularWeight: 409.228006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)C(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3)C(F)F

Isomeric SMILES

CC1=CC(=NN1C(C)C(=O)NC2=C3C(=C(C=C2)Br)C=CC=N3)C(F)F

InChI

InChI=1S/C17H15BrF2N4O/c1-9-8-14(16(19)20)23-24(9)10(2)17(25)22-13-6-5-12(18)11-4-3-7-21-15(11)13/h3-8,10,16H,1-2H3,(H,22,25)