2-[[6-[(3R)-3-azanylpiperidin-1-yl]-2-oxidanylidene-3-pyridin-3-yl-pyridin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[6-[(3R)-3-azanylpiperidin-1-yl]-2-oxidanylidene-3-pyridin-3-yl-pyridin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[6-[(3R)-3-amino-1-piperidyl]-2-oxo-3-(3-pyridyl)-1-pyridyl]methyl]benzonitrile CAS Name: 2-[[6-[(3R)-3-amino-1-piperidinyl]-2-oxo-3-(3-pyridinyl)-1-pyridinyl]methyl]benzonitrile IUPAC Name: 2-[[6-[(3R)-3-aminopiperidin-1-yl]-2-oxo-3-pyridin-3-ylpyridin-1-yl]methyl]benzonitrile Traditional Name: 2-[[6-[(3R)-3-aminopiperidino]-2-keto-3-(3-pyridyl)-1-pyridyl]methyl]benzonitrile Formula: C23H23N5O MolecularWeight: 385.46162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=C(C(=O)N2CC3=CC=CC=C3C#N)C4=CN=CC=C4)N

Isomeric SMILES

C1C[C@H](CN(C1)C2=CC=C(C(=O)N2CC3=CC=CC=C3C#N)C4=CN=CC=C4)N

InChI

InChI=1S/C23H23N5O/c24-13-17-5-1-2-6-19(17)15-28-22(27-12-4-8-20(25)16-27)10-9-21(23(28)29)18-7-3-11-26-14-18/h1-3,5-7,9-11,14,20H,4,8,12,15-16,25H2/t20-/m1/s1