(2S)-2-(4-ethanoylpiperazin-1-yl)-2-pyridin-3-yl-ethanenitrile

Systemtic Name: (2S)-2-(4-ethanoylpiperazin-1-yl)-2-pyridin-3-yl-ethanenitrile Openeye Name: (2S)-2-(4-acetylpiperazin-1-yl)-2-(3-pyridyl)acetonitrile CAS Name: (2S)-2-(4-acetyl-1-piperazinyl)-2-(3-pyridinyl)acetonitrile IUPAC Name: (2S)-2-(4-acetylpiperazin-1-yl)-2-pyridin-3-ylacetonitrile Traditional Name: (2S)-2-(4-acetylpiperazino)-2-(3-pyridyl)acetonitrile Formula: C13H16N4O MolecularWeight: 244.29234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(C#N)C2=CN=CC=C2

Isomeric SMILES

CC(=O)N1CCN(CC1)[C@H](C#N)C2=CN=CC=C2

InChI

InChI=1S/C13H16N4O/c1-11(18)16-5-7-17(8-6-16)13(9-14)12-3-2-4-15-10-12/h2-4,10,13H,5-8H2,1H3/t13-/m1/s1