(2S)-1-[(8-methoxyquinolin-2-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-2-carboxamide

Systemtic Name: (2S)-1-[(8-methoxyquinolin-2-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-2-carboxamide Openeye Name: (2S)-1-[(8-methoxy-2-quinolyl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-2-carboxamide CAS Name: (2S)-1-[(8-methoxy-2-quinolinyl)methyl]-N-[4-(1-pyrazolyl)phenyl]-2-piperidinecarboxamide IUPAC Name: (2S)-1-[(8-methoxyquinolin-2-yl)methyl]-N-(4-pyrazol-1-ylphenyl)piperidine-2-carboxamide Traditional Name: (2S)-1-[(8-methoxy-2-quinolyl)methyl]-N-(4-pyrazol-1-ylphenyl)pipecolinamide Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1N=C(C=C2)CN3CCCCC3C(=O)NC4=CC=C(C=C4)N5C=CC=N5

Isomeric SMILES

COC1=CC=CC2=C1N=C(C=C2)CN3CCCC[C@H]3C(=O)NC4=CC=C(C=C4)N5C=CC=N5

InChI

InChI=1S/C26H27N5O2/c1-33-24-8-4-6-19-9-10-21(28-25(19)24)18-30-16-3-2-7-23(30)26(32)29-20-11-13-22(14-12-20)31-17-5-15-27-31/h4-6,8-15,17,23H,2-3,7,16,18H2,1H3,(H,29,32)/t23-/m0/s1