1-(5-cyanopyridin-2-yl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]piperidine-4-carboxamide

Systemtic Name: 1-(5-cyanopyridin-2-yl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]piperidine-4-carboxamide Openeye Name: 1-(5-cyano-2-pyridyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]piperidine-4-carboxamide CAS Name: 1-(5-cyano-2-pyridinyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-piperidinecarboxamide IUPAC Name: 1-(5-cyanopyridin-2-yl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]piperidine-4-carboxamide Traditional Name: 1-(5-cyano-2-pyridyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]isonipecotamide Formula: C25H31N5O MolecularWeight: 417.54654

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1CCN(CC1)C2=NC=C(C=C2)C#N)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(CNC(=O)C1CCN(CC1)C2=NC=C(C=C2)C#N)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H31N5O/c1-2-23(30-14-9-20-5-3-4-6-22(20)18-30)17-28-25(31)21-10-12-29(13-11-21)24-8-7-19(15-26)16-27-24/h3-8,16,21,23H,2,9-14,17-18H2,1H3,(H,28,31)