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

Systemtic Name: 2-[[2-[(3R)-3-azanylpiperidin-1-yl]-6-oxidanylidene-pyrimidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[2-[(3R)-3-amino-1-piperidyl]-6-oxo-pyrimidin-1-yl]methyl]benzonitrile CAS Name: 2-[[2-[(3R)-3-amino-1-piperidinyl]-6-oxo-1-pyrimidinyl]methyl]benzonitrile IUPAC Name: 2-[[2-[(3R)-3-aminopiperidin-1-yl]-6-oxopyrimidin-1-yl]methyl]benzonitrile Traditional Name: 2-[[2-[(3R)-3-aminopiperidino]-6-keto-pyrimidin-1-yl]methyl]benzonitrile Formula: C17H19N5O MolecularWeight: 309.36566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N5O/c18-10-13-4-1-2-5-14(13)11-22-16(23)7-8-20-17(22)21-9-3-6-15(19)12-21/h1-2,4-5,7-8,15H,3,6,9,11-12,19H2/t15-/m1/s1