(2R)-N-(4-azanylcyclohexyl)-4-[oxolan-2-ylmethyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-4-[oxolan-2-ylmethyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(tetrahydrofuran-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-4-[2-oxolanylmethyl-(phenylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(oxolan-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(tetrahydrofurfuryl)amino]-1-nicotinoyl-pipecolinamide Formula: C30H41N5O3 MolecularWeight: 519.67824

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=CC=CC=C2)C3CCN(C(C3)C(=O)NC4CCC(CC4)N)C(=O)C5=CN=CC=C5

Isomeric SMILES

C1CC(OC1)CN(CC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NC4CCC(CC4)N)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C30H41N5O3/c31-24-10-12-25(13-11-24)33-29(36)28-18-26(14-16-35(28)30(37)23-8-4-15-32-19-23)34(21-27-9-5-17-38-27)20-22-6-2-1-3-7-22/h1-4,6-8,15,19,24-28H,5,9-14,16-18,20-21,31H2,(H,33,36)/t24?,25?,26?,27?,28-/m1/s1