1-[[2-ethyl-5-fluoranyl-4-[[2-methyl-4-(4-methyl-1H-pyrazol-5-yl)quinolin-8-yl]oxymethyl]pyridin-3-yl]methyl]-2-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[[2-ethyl-5-fluoranyl-4-[[2-methyl-4-(4-methyl-1H-pyrazol-5-yl)quinolin-8-yl]oxymethyl]pyridin-3-yl]methyl]-2-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 1-[[2-ethyl-5-fluoro-4-[[2-methyl-4-(4-methyl-1H-pyrazol-5-yl)-8-quinolyl]oxymethyl]-3-pyridyl]methyl]-2-oxo-pyridine-3-carbonitrile CAS Name: 1-[[2-ethyl-5-fluoro-4-[[2-methyl-4-(4-methyl-1H-pyrazol-5-yl)-8-quinolinyl]oxymethyl]-3-pyridinyl]methyl]-2-oxo-3-pyridinecarbonitrile IUPAC Name: 1-[[2-ethyl-5-fluoro-4-[[2-methyl-4-(4-methyl-1H-pyrazol-5-yl)quinolin-8-yl]oxymethyl]pyridin-3-yl]methyl]-2-oxopyridine-3-carbonitrile Traditional Name: 1-[[2-ethyl-5-fluoro-4-[[2-methyl-4-(4-methyl-1H-pyrazol-5-yl)-8-quinolyl]oxymethyl]-3-pyridyl]methyl]-2-keto-nicotinonitrile Formula: C29H25FN6O2 MolecularWeight: 508.546203

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C(=C1CN2C=CC=C(C2=O)C#N)COC3=CC=CC4=C3N=C(C=C4C5=C(C=NN5)C)C)F

Isomeric SMILES

CCC1=NC=C(C(=C1CN2C=CC=C(C2=O)C#N)COC3=CC=CC4=C3N=C(C=C4C5=C(C=NN5)C)C)F

InChI

InChI=1S/C29H25FN6O2/c1-4-25-22(15-36-10-6-7-19(12-31)29(36)37)23(24(30)14-32-25)16-38-26-9-5-8-20-21(11-18(3)34-28(20)26)27-17(2)13-33-35-27/h5-11,13-14H,4,15-16H2,1-3H3,(H,33,35)