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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CCC2C3=C(CCN2)C=C(C=C3)C#N)NC(=O)C4=CC=CC(=C4)C5=CN=CC=C5

Isomeric SMILES

C1CCC(CC1)(CCC2C3=C(CCN2)C=C(C=C3)C#N)NC(=O)C4=CC=CC(=C4)C5=CN=CC=C5

InChI

InChI=1S/C30H32N4O/c31-20-22-9-10-27-24(18-22)12-17-33-28(27)11-15-30(13-2-1-3-14-30)34-29(35)25-7-4-6-23(19-25)26-8-5-16-32-21-26/h4-10,16,18-19,21,28,33H,1-3,11-15,17H2,(H,34,35)