1-[2-azanyl-4-(pyridin-4-ylmethylamino)butanoyl]piperidine-2-carbonitrile

Systemtic Name: 1-[2-azanyl-4-(pyridin-4-ylmethylamino)butanoyl]piperidine-2-carbonitrile Openeye Name: 1-[2-amino-4-(4-pyridylmethylamino)butanoyl]piperidine-2-carbonitrile CAS Name: 1-[2-amino-1-oxo-4-(pyridin-4-ylmethylamino)butyl]-2-piperidinecarbonitrile IUPAC Name: 1-[2-amino-4-(pyridin-4-ylmethylamino)butanoyl]piperidine-2-carbonitrile Traditional Name: 1-[2-amino-4-(4-pyridylmethylamino)butanoyl]pipecolinonitrile Formula: C16H23N5O MolecularWeight: 301.38672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C#N)C(=O)C(CCNCC2=CC=NC=C2)N

Isomeric SMILES

C1CCN(C(C1)C#N)C(=O)C(CCNCC2=CC=NC=C2)N

InChI

InChI=1S/C16H23N5O/c17-11-14-3-1-2-10-21(14)16(22)15(18)6-9-20-12-13-4-7-19-8-5-13/h4-5,7-8,14-15,20H,1-3,6,9-10,12,18H2