N-[4-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]-3-pyridin-3-yl-benzamide

Systemtic Name: N-[4-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]-3-pyridin-3-yl-benzamide Openeye Name: N-[4-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]-3-(3-pyridyl)benzamide CAS Name: N-[4-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]-3-(3-pyridinyl)benzamide IUPAC Name: N-[4-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]-3-pyridin-3-ylbenzamide Traditional Name: N-[4-[2-(6-cyano-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]cyclohexyl]-3-(3-pyridyl)benzamide Formula: C30H32N4O MolecularWeight: 464.60128

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCN2CCC3=C(C2)C=CC(=C3)C#N)NC(=O)C4=CC=CC(=C4)C5=CN=CC=C5

Isomeric SMILES

C1CC(CCC1CCN2CCC3=C(C2)C=CC(=C3)C#N)NC(=O)C4=CC=CC(=C4)C5=CN=CC=C5

InChI

InChI=1S/C30H32N4O/c31-19-23-6-9-28-21-34(16-13-25(28)17-23)15-12-22-7-10-29(11-8-22)33-30(35)26-4-1-3-24(18-26)27-5-2-14-32-20-27/h1-6,9,14,17-18,20,22,29H,7-8,10-13,15-16,21H2,(H,33,35)