2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(1,7-dipyridin-4-ylheptan-4-yl)ethanamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(1,7-dipyridin-4-ylheptan-4-yl)ethanamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[4-(4-pyridyl)-1-[3-(4-pyridyl)propyl]butyl]acetamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(1,7-dipyridin-4-ylheptan-4-yl)acetamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(1,7-dipyridin-4-ylheptan-4-yl)acetamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[4-(4-pyridyl)-1-[3-(4-pyridyl)propyl]butyl]acetamide Formula: C28H34N4O MolecularWeight: 442.59576

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(=O)NC(CCCC3=CC=NC=C3)CCCC4=CC=NC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(=O)NC(CCCC3=CC=NC=C3)CCCC4=CC=NC=C4

InChI

InChI=1S/C28H34N4O/c33-28(22-32-20-15-25-7-1-2-8-26(25)21-32)31-27(9-3-5-23-11-16-29-17-12-23)10-4-6-24-13-18-30-19-14-24/h1-2,7-8,11-14,16-19,27H,3-6,9-10,15,20-22H2,(H,31,33)