1-(6-methoxypyridazin-3-yl)-N-[3-oxidanylidene-3-(pyridin-2-ylamino)propyl]-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(6-methoxypyridazin-3-yl)-N-[3-oxidanylidene-3-(pyridin-2-ylamino)propyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: 1-(6-methoxypyridazin-3-yl)-N-[3-oxo-3-(2-pyridylamino)propyl]-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(6-methoxy-3-pyridazinyl)-N-[3-oxo-3-(2-pyridinylamino)propyl]-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: 1-(6-methoxypyridazin-3-yl)-N-[3-oxo-3-(pyridin-2-ylamino)propyl]-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-[3-keto-3-(2-pyridylamino)propyl]-1-(6-methoxypyridazin-3-yl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C18H16F3N7O3 MolecularWeight: 435.35995

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NCCC(=O)NC3=CC=CC=N3)C(F)(F)F

Isomeric SMILES

COC1=NN=C(C=C1)N2C(=C(C=N2)C(=O)NCCC(=O)NC3=CC=CC=N3)C(F)(F)F

InChI

InChI=1S/C18H16F3N7O3/c1-31-15-6-5-13(26-27-15)28-16(18(19,20)21)11(10-24-28)17(30)23-9-7-14(29)25-12-4-2-3-8-22-12/h2-6,8,10H,7,9H2,1H3,(H,23,30)(H,22,25,29)