2-[4,6-di(piperidin-1-yl)pyrimidin-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[4,6-di(piperidin-1-yl)pyrimidin-2-yl]sulfanylethanenitrile Openeye Name: 2-[4,6-bis(1-piperidyl)pyrimidin-2-yl]sulfanylacetonitrile CAS Name: 2-[[4,6-bis(1-piperidinyl)-2-pyrimidinyl]thio]acetonitrile IUPAC Name: 2-[4,6-di(piperidin-1-yl)pyrimidin-2-yl]sulfanylacetonitrile Traditional Name: 2-[(4,6-dipiperidinopyrimidin-2-yl)thio]acetonitrile Formula: C16H23N5S MolecularWeight: 317.45232

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC(=N2)SCC#N)N3CCCCC3

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC(=N2)SCC#N)N3CCCCC3

InChI

InChI=1S/C16H23N5S/c17-7-12-22-16-18-14(20-8-3-1-4-9-20)13-15(19-16)21-10-5-2-6-11-21/h13H,1-6,8-12H2