1-[(3R)-1-cyclohexylpiperidin-3-yl]-N-(pyridin-3-ylmethyl)-N-[(1-pyridin-2-ylpyrrol-2-yl)methyl]methanamine

Systemtic Name: 1-[(3R)-1-cyclohexylpiperidin-3-yl]-N-(pyridin-3-ylmethyl)-N-[(1-pyridin-2-ylpyrrol-2-yl)methyl]methanamine Openeye Name: 1-[(3R)-1-cyclohexyl-3-piperidyl]-N-(3-pyridylmethyl)-N-[[1-(2-pyridyl)pyrrol-2-yl]methyl]methanamine CAS Name: 1-[(3R)-1-cyclohexyl-3-piperidinyl]-N-(3-pyridinylmethyl)-N-[[1-(2-pyridinyl)-2-pyrrolyl]methyl]methanamine IUPAC Name: 1-[(3R)-1-cyclohexylpiperidin-3-yl]-N-(pyridin-3-ylmethyl)-N-[(1-pyridin-2-ylpyrrol-2-yl)methyl]methanamine Traditional Name: [(3R)-1-cyclohexyl-3-piperidyl]methyl-(3-pyridylmethyl)-[[1-(2-pyridyl)pyrrol-2-yl]methyl]amine Formula: C28H37N5 MolecularWeight: 443.62688

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCCC(C2)CN(CC3=CN=CC=C3)CC4=CC=CN4C5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)N2CCC[C@@H](C2)CN(CC3=CN=CC=C3)CC4=CC=CN4C5=CC=CC=N5

InChI

InChI=1S/C28H37N5/c1-2-11-26(12-3-1)32-17-7-10-25(22-32)21-31(20-24-9-6-15-29-19-24)23-27-13-8-18-33(27)28-14-4-5-16-30-28/h4-6,8-9,13-16,18-19,25-26H,1-3,7,10-12,17,20-23H2/t25-/m1/s1