N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-1-(6-oxidanylidene-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(2,3-dihydrobenzofuran-2-ylmethyl)-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-(2,3-dihydrobenzofuran-2-ylmethyl)-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(2,3-dihydro-1-benzofuran-2-ylmethyl)-1-(6-oxo-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(coumaran-2-ylmethyl)-1-(6-keto-1H-pyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C18H14F3N5O3 MolecularWeight: 405.33067

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C21)CNC(=O)C3=C(N(N=C3)C4=NNC(=O)C=C4)C(F)(F)F

Isomeric SMILES

C1C(OC2=CC=CC=C21)CNC(=O)C3=C(N(N=C3)C4=NNC(=O)C=C4)C(F)(F)F

InChI

InChI=1S/C18H14F3N5O3/c19-18(20,21)16-12(9-23-26(16)14-5-6-15(27)25-24-14)17(28)22-8-11-7-10-3-1-2-4-13(10)29-11/h1-6,9,11H,7-8H2,(H,22,28)(H,25,27)