6-[3,5-bis[4-methoxy-6-(pyridin-2-ylmethylamino)pyridin-2-yl]cyclohexyl]-4-methoxy-N-(pyridin-2-ylmethyl)pyridin-2-amine

Systemtic Name: 6-[3,5-bis[4-methoxy-6-(pyridin-2-ylmethylamino)pyridin-2-yl]cyclohexyl]-4-methoxy-N-(pyridin-2-ylmethyl)pyridin-2-amine Openeye Name: 6-[3,5-bis[4-methoxy-6-(2-pyridylmethylamino)-2-pyridyl]cyclohexyl]-4-methoxy-N-(2-pyridylmethyl)pyridin-2-amine CAS Name: 6-[3,5-bis[4-methoxy-6-(2-pyridinylmethylamino)-2-pyridinyl]cyclohexyl]-4-methoxy-N-(2-pyridinylmethyl)-2-pyridinamine IUPAC Name: 6-[3,5-bis[4-methoxy-6-(pyridin-2-ylmethylamino)pyridin-2-yl]cyclohexyl]-4-methoxy-N-(pyridin-2-ylmethyl)pyridin-2-amine Traditional Name: [6-[3,5-bis[4-methoxy-6-(2-pyridylmethylamino)-2-pyridyl]cyclohexyl]-4-methoxy-2-pyridyl]-(2-pyridylmethyl)amine Formula: C42H45N9O3 MolecularWeight: 723.8652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=C1)NCC2=CC=CC=N2)C3CC(CC(C3)C4=NC(=CC(=C4)OC)NCC5=CC=CC=N5)C6=NC(=CC(=C6)OC)NCC7=CC=CC=N7

Isomeric SMILES

COC1=CC(=NC(=C1)NCC2=CC=CC=N2)C3CC(CC(C3)C4=NC(=CC(=C4)OC)NCC5=CC=CC=N5)C6=NC(=CC(=C6)OC)NCC7=CC=CC=N7

InChI

InChI=1S/C42H45N9O3/c1-52-34-19-37(49-40(22-34)46-25-31-10-4-7-13-43-31)28-16-29(38-20-35(53-2)23-41(50-38)47-26-32-11-5-8-14-44-32)18-30(17-28)39-21-36(54-3)24-42(51-39)48-27-33-12-6-9-15-45-33/h4-15,19-24,28-30H,16-18,25-27H2,1-3H3,(H,46,49)(H,47,50)(H,48,51)