2-[4-[2-[methyl(3-phenylpropyl)amino]ethanoyl]piperazin-1-yl]-2-pyridin-3-yl-ethanenitrile

Systemtic Name: 2-[4-[2-[methyl(3-phenylpropyl)amino]ethanoyl]piperazin-1-yl]-2-pyridin-3-yl-ethanenitrile Openeye Name: 2-[4-[2-[methyl(3-phenylpropyl)amino]acetyl]piperazin-1-yl]-2-(3-pyridyl)acetonitrile CAS Name: 2-[4-[2-[methyl(3-phenylpropyl)amino]-1-oxoethyl]-1-piperazinyl]-2-(3-pyridinyl)acetonitrile IUPAC Name: 2-[4-[2-[methyl(3-phenylpropyl)amino]acetyl]piperazin-1-yl]-2-pyridin-3-ylacetonitrile Traditional Name: 2-[4-[2-[methyl(3-phenylpropyl)amino]acetyl]piperazino]-2-(3-pyridyl)acetonitrile Formula: C23H29N5O MolecularWeight: 391.50926

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC1=CC=CC=C1)CC(=O)N2CCN(CC2)C(C#N)C3=CN=CC=C3

Isomeric SMILES

CN(CCCC1=CC=CC=C1)CC(=O)N2CCN(CC2)C(C#N)C3=CN=CC=C3

InChI

InChI=1S/C23H29N5O/c1-26(12-6-9-20-7-3-2-4-8-20)19-23(29)28-15-13-27(14-16-28)22(17-24)21-10-5-11-25-18-21/h2-5,7-8,10-11,18,22H,6,9,12-16,19H2,1H3