6-[1-[1-[(2-azanylpyridin-4-yl)methyl]-4-fluoranyl-piperidin-4-yl]carbonylpiperidin-4-yl]oxypyridine-3-carbonitrile

Systemtic Name: 6-[1-[1-[(2-azanylpyridin-4-yl)methyl]-4-fluoranyl-piperidin-4-yl]carbonylpiperidin-4-yl]oxypyridine-3-carbonitrile Openeye Name: 6-[[1-[1-[(2-amino-4-pyridyl)methyl]-4-fluoro-piperidine-4-carbonyl]-4-piperidyl]oxy]pyridine-3-carbonitrile CAS Name: 6-[[1-[[1-[(2-amino-4-pyridinyl)methyl]-4-fluoro-4-piperidinyl]-oxomethyl]-4-piperidinyl]oxy]-3-pyridinecarbonitrile IUPAC Name: 6-[1-[1-[(2-aminopyridin-4-yl)methyl]-4-fluoropiperidine-4-carbonyl]piperidin-4-yl]oxypyridine-3-carbonitrile Traditional Name: 6-[[1-[1-[(2-amino-4-pyridyl)methyl]-4-fluoro-isonipecotoyl]-4-piperidyl]oxy]nicotinonitrile Formula: C23H27FN6O2 MolecularWeight: 438.497883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=NC=C(C=C2)C#N)C(=O)C3(CCN(CC3)CC4=CC(=NC=C4)N)F

Isomeric SMILES

C1CN(CCC1OC2=NC=C(C=C2)C#N)C(=O)C3(CCN(CC3)CC4=CC(=NC=C4)N)F

InChI

InChI=1S/C23H27FN6O2/c24-23(6-11-29(12-7-23)16-17-3-8-27-20(26)13-17)22(31)30-9-4-19(5-10-30)32-21-2-1-18(14-25)15-28-21/h1-3,8,13,15,19H,4-7,9-12,16H2,(H2,26,27)