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

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[oxolan-2-ylmethyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[benzyl(tetrahydrofuran-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[2-oxolanylmethyl-(phenylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[benzyl(oxolan-2-ylmethyl)amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[benzyl(tetrahydrofurfuryl)amino]-1-nicotinoyl-pipecolinamide Formula: C26H35N5O3 MolecularWeight: 465.5878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CC2=CC=CC=C2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CC(OC1)CN(CC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C26H35N5O3/c27-11-13-29-25(32)24-16-22(10-14-31(24)26(33)21-8-4-12-28-17-21)30(19-23-9-5-15-34-23)18-20-6-2-1-3-7-20/h1-4,6-8,12,17,22-24H,5,9-11,13-16,18-19,27H2,(H,29,32)/t22?,23?,24-/m1/s1