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

Systemtic Name: (2R)-N-(4-azanylcyclohexyl)-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(4-aminocyclohexyl)-4-[2-methoxyethyl(o-tolylmethyl)amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(4-aminocyclohexyl)-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(4-aminocyclohexyl)-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(4-aminocyclohexyl)-4-[2-methoxyethyl-(2-methylbenzyl)amino]-1-nicotinoyl-pipecolinamide Formula: C29H41N5O3 MolecularWeight: 507.66754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CCOC)C2CCN(C(C2)C(=O)NC3CCC(CC3)N)C(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN(CCOC)C2CCN([C@H](C2)C(=O)NC3CCC(CC3)N)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C29H41N5O3/c1-21-6-3-4-7-23(21)20-33(16-17-37-2)26-13-15-34(29(36)22-8-5-14-31-19-22)27(18-26)28(35)32-25-11-9-24(30)10-12-25/h3-8,14,19,24-27H,9-13,15-18,20,30H2,1-2H3,(H,32,35)/t24?,25?,26?,27-/m1/s1