5-[6-oxidanylidene-3-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-1-yl]pentanenitrile

Systemtic Name: 5-[6-oxidanylidene-3-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-1-yl]pentanenitrile Openeye Name: 5-[6-oxo-3-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-1-yl]pentanenitrile CAS Name: 5-[6-oxo-3-[3-(2-pyrazolo[1,5-a]pyridinyl)phenyl]-1-pyridazinyl]pentanenitrile IUPAC Name: 5-[6-oxo-3-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-1-yl]pentanenitrile Traditional Name: 5-[6-keto-3-(3-pyrazolo[1,5-a]pyridin-2-ylphenyl)pyridazin-1-yl]valeronitrile Formula: C22H19N5O MolecularWeight: 369.41916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=NN2C=C1)C3=CC=CC(=C3)C4=NN(C(=O)C=C4)CCCCC#N

Isomeric SMILES

C1=CC2=CC(=NN2C=C1)C3=CC=CC(=C3)C4=NN(C(=O)C=C4)CCCCC#N

InChI

InChI=1S/C22H19N5O/c23-12-3-1-4-14-27-22(28)11-10-20(24-27)17-7-6-8-18(15-17)21-16-19-9-2-5-13-26(19)25-21/h2,5-11,13,15-16H,1,3-4,14H2