2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-quinolin-8-yl-ethanamide

Systemtic Name: 2-[4-bromanyl-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-quinolin-8-yl-ethanamide Openeye Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(8-quinolyl)acetamide CAS Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)-1-pyrazolyl]-N-(8-quinolinyl)acetamide IUPAC Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-quinolin-8-ylacetamide Traditional Name: 2-[4-bromo-5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(8-quinolyl)acetamide Formula: C18H14BrF3N4O MolecularWeight: 439.22917

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C(=NN2CC(=O)NC3=CC=CC4=C3N=CC=C4)C(F)(F)F)Br

Isomeric SMILES

C1CC1C2=C(C(=NN2CC(=O)NC3=CC=CC4=C3N=CC=C4)C(F)(F)F)Br

InChI

InChI=1S/C18H14BrF3N4O/c19-14-16(11-6-7-11)26(25-17(14)18(20,21)22)9-13(27)24-12-5-1-3-10-4-2-8-23-15(10)12/h1-5,8,11H,6-7,9H2,(H,24,27)