(2S)-2-ethyl-N-(3-pyridin-2-ylisoquinolin-1-yl)hexanamide

Systemtic Name: (2S)-2-ethyl-N-(3-pyridin-2-ylisoquinolin-1-yl)hexanamide Openeye Name: (2S)-2-ethyl-N-[3-(2-pyridyl)-1-isoquinolyl]hexanamide CAS Name: (2S)-2-ethyl-N-[3-(2-pyridinyl)-1-isoquinolinyl]hexanamide IUPAC Name: (2S)-2-ethyl-N-(3-pyridin-2-ylisoquinolin-1-yl)hexanamide Traditional Name: (2S)-2-ethyl-N-[3-(2-pyridyl)-1-isoquinolyl]hexanamide Formula: C22H25N3O MolecularWeight: 347.4534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=NC(=CC2=CC=CC=C21)C3=CC=CC=N3

Isomeric SMILES

CCCC[C@H](CC)C(=O)NC1=NC(=CC2=CC=CC=C21)C3=CC=CC=N3

InChI

InChI=1S/C22H25N3O/c1-3-5-10-16(4-2)22(26)25-21-18-12-7-6-11-17(18)15-20(24-21)19-13-8-9-14-23-19/h6-9,11-16H,3-5,10H2,1-2H3,(H,24,25,26)/t16-/m0/s1