N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(4-pyridylmethylamino)pyridine-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-homoveratryl-2-(4-pyridylmethylamino)nicotinamide Formula: C22H24N4O3 MolecularWeight: 392.45096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=C(N=CC=C2)NCC3=CC=NC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=C(N=CC=C2)NCC3=CC=NC=C3)OC

InChI

InChI=1S/C22H24N4O3/c1-28-19-6-5-16(14-20(19)29-2)9-13-25-22(27)18-4-3-10-24-21(18)26-15-17-7-11-23-12-8-17/h3-8,10-12,14H,9,13,15H2,1-2H3,(H,24,26)(H,25,27)