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

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl-[(3-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-4-[(3-methoxyphenyl)methyl-(phenylmethyl)amino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl-[(3-methoxyphenyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-4-[benzyl(m-anisyl)amino]-1-nicotinoyl-pipecolinamide Formula: C33H41N5O3 MolecularWeight: 555.71034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2=CC=CC=C2)C3CCN(C(C3)C(=O)NC4CCC(CC4)N)C(=O)C5=CN=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NC4CCC(CC4)N)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C33H41N5O3/c1-41-30-11-5-9-25(19-30)23-37(22-24-7-3-2-4-8-24)29-16-18-38(33(40)26-10-6-17-35-21-26)31(20-29)32(39)36-28-14-12-27(34)13-15-28/h2-11,17,19,21,27-29,31H,12-16,18,20,22-23,34H2,1H3,(H,36,39)/t27?,28?,29?,31-/m1/s1