1-[2-azanyl-5-[[1-(phenylmethyl)piperidin-4-yl]amino]pentanoyl]piperidine-2-carbonitrile

Systemtic Name: 1-[2-azanyl-5-[[1-(phenylmethyl)piperidin-4-yl]amino]pentanoyl]piperidine-2-carbonitrile Openeye Name: 1-[2-amino-5-[(1-benzyl-4-piperidyl)amino]pentanoyl]piperidine-2-carbonitrile CAS Name: 1-[2-amino-1-oxo-5-[[1-(phenylmethyl)-4-piperidinyl]amino]pentyl]-2-piperidinecarbonitrile IUPAC Name: 1-[2-amino-5-[(1-benzylpiperidin-4-yl)amino]pentanoyl]piperidine-2-carbonitrile Traditional Name: 1-[2-amino-5-[(1-benzyl-4-piperidyl)amino]pentanoyl]pipecolinonitrile Formula: C23H35N5O MolecularWeight: 397.5569

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C#N)C(=O)C(CCCNC2CCN(CC2)CC3=CC=CC=C3)N

Isomeric SMILES

C1CCN(C(C1)C#N)C(=O)C(CCCNC2CCN(CC2)CC3=CC=CC=C3)N

InChI

InChI=1S/C23H35N5O/c24-17-21-9-4-5-14-28(21)23(29)22(25)10-6-13-26-20-11-15-27(16-12-20)18-19-7-2-1-3-8-19/h1-3,7-8,20-22,26H,4-6,9-16,18,25H2