N-[2-(diethylamino)-2-phenyl-ethyl]-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-[2-(diethylamino)-2-phenyl-ethyl]-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-[2-(diethylamino)-2-phenyl-ethyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-[2-(diethylamino)-2-phenylethyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-[2-(diethylamino)-2-phenylethyl]-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[2-(diethylamino)-2-phenyl-ethyl]-1-(6-keto-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C21H23F3N6O2 MolecularWeight: 448.44153

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)C1=C(N(N=C1)C2=NNC(=O)C=C2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)C1=C(N(N=C1)C2=NNC(=O)C=C2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C21H23F3N6O2/c1-3-29(4-2)16(14-8-6-5-7-9-14)13-25-20(32)15-12-26-30(19(15)21(22,23)24)17-10-11-18(31)28-27-17/h5-12,16H,3-4,13H2,1-2H3,(H,25,32)(H,28,31)