1-(6-oxidanylidene-1H-pyridazin-3-yl)-N-(2-quinolin-8-ylethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(6-oxidanylidene-1H-pyridazin-3-yl)-N-(2-quinolin-8-ylethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-(6-oxo-1H-pyridazin-3-yl)-N-[2-(8-quinolyl)ethyl]-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(6-oxo-1H-pyridazin-3-yl)-N-[2-(8-quinolinyl)ethyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(6-oxo-1H-pyridazin-3-yl)-N-(2-quinolin-8-ylethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: 1-(6-keto-1H-pyridazin-3-yl)-N-[2-(8-quinolyl)ethyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C20H15F3N6O2 MolecularWeight: 428.36731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CCNC(=O)C3=C(N(N=C3)C4=NNC(=O)C=C4)C(F)(F)F)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CCNC(=O)C3=C(N(N=C3)C4=NNC(=O)C=C4)C(F)(F)F)N=CC=C2

InChI

InChI=1S/C20H15F3N6O2/c21-20(22,23)18-14(11-26-29(18)15-6-7-16(30)28-27-15)19(31)25-10-8-13-4-1-3-12-5-2-9-24-17(12)13/h1-7,9,11H,8,10H2,(H,25,31)(H,28,30)