N-(3-azanylpropyl)-6-[[[3,5-bis(pyridin-2-ylmethylamino)cyclohexyl]amino]methyl]pyridine-3-carboxamide

Systemtic Name: N-(3-azanylpropyl)-6-[[[3,5-bis(pyridin-2-ylmethylamino)cyclohexyl]amino]methyl]pyridine-3-carboxamide Openeye Name: N-(3-aminopropyl)-6-[[[3,5-bis(2-pyridylmethylamino)cyclohexyl]amino]methyl]pyridine-3-carboxamide CAS Name: N-(3-aminopropyl)-6-[[[3,5-bis(2-pyridinylmethylamino)cyclohexyl]amino]methyl]-3-pyridinecarboxamide IUPAC Name: N-(3-aminopropyl)-6-[[[3,5-bis(pyridin-2-ylmethylamino)cyclohexyl]amino]methyl]pyridine-3-carboxamide Traditional Name: N-(3-aminopropyl)-6-[[[3,5-bis(2-pyridylmethylamino)cyclohexyl]amino]methyl]nicotinamide Formula: C28H38N8O MolecularWeight: 502.65432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(CC1NCC2=CC=CC=N2)NCC3=CC=CC=N3)NCC4=NC=C(C=C4)C(=O)NCCCN

Isomeric SMILES

C1C(CC(CC1NCC2=CC=CC=N2)NCC3=CC=CC=N3)NCC4=NC=C(C=C4)C(=O)NCCCN

InChI

InChI=1S/C28H38N8O/c29-10-5-13-32-28(37)21-8-9-24(33-17-21)20-36-27-15-25(34-18-22-6-1-3-11-30-22)14-26(16-27)35-19-23-7-2-4-12-31-23/h1-4,6-9,11-12,17,25-27,34-36H,5,10,13-16,18-20,29H2,(H,32,37)