2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide

Systemtic Name: 2-(2-ethanoyl-1H-isoquinolin-1-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide Openeye Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[5-(1-piperidyl)-8-isoquinolyl]acetamide CAS Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-[5-(1-piperidinyl)-8-isoquinolinyl]acetamide IUPAC Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)acetamide Traditional Name: 2-(2-acetyl-1H-isoquinolin-1-yl)-N-(5-piperidino-8-isoquinolyl)acetamide Formula: C27H28N4O2 MolecularWeight: 440.53682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCCCC5

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCCCC5

InChI

InChI=1S/C27H28N4O2/c1-19(32)31-16-12-20-7-3-4-8-21(20)26(31)17-27(33)29-24-9-10-25(30-14-5-2-6-15-30)22-11-13-28-18-23(22)24/h3-4,7-13,16,18,26H,2,5-6,14-15,17H2,1H3,(H,29,33)