(2R)-N-(4-azanylcyclohexyl)-4-[(4-methoxyphenyl)methyl-phenethyl-amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-4-[(4-methoxyphenyl)methyl-phenethyl-amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-phenethyl-amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-phenethylamino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[(4-methoxyphenyl)methyl-phenethylamino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-1-nicotinoyl-4-[p-anisyl(phenethyl)amino]pipecolinamide Formula: C34H43N5O3 MolecularWeight: 569.73692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CCN(C(C3)C(=O)NC4CCC(CC4)N)C(=O)C5=CN=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)CN(CCC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NC4CCC(CC4)N)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C34H43N5O3/c1-42-31-15-9-26(10-16-31)24-38(20-17-25-6-3-2-4-7-25)30-18-21-39(34(41)27-8-5-19-36-23-27)32(22-30)33(40)37-29-13-11-28(35)12-14-29/h2-10,15-16,19,23,28-30,32H,11-14,17-18,20-22,24,35H2,1H3,(H,37,40)/t28?,29?,30?,32-/m1/s1