8-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]octanenitrile

Systemtic Name: 8-[6-oxidanylidene-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]octanenitrile Openeye Name: 8-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]octanenitrile CAS Name: 8-[6-oxo-3-(2-phenyl-3-pyrazolo[1,5-a]pyridinyl)-1-pyridazinyl]octanenitrile IUPAC Name: 8-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]octanenitrile Traditional Name: 8-[6-keto-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]caprylonitrile Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN3C=CC=CC3=C2C4=NN(C(=O)C=C4)CCCCCCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN3C=CC=CC3=C2C4=NN(C(=O)C=C4)CCCCCCCC#N

InChI

InChI=1S/C25H25N5O/c26-17-9-3-1-2-4-10-19-30-23(31)16-15-21(27-30)24-22-14-8-11-18-29(22)28-25(24)20-12-6-5-7-13-20/h5-8,11-16,18H,1-4,9-10,19H2