(2R)-2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(2-methoxyethyl)ethanamide

Systemtic Name: (2R)-2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(2-methoxyethyl)ethanamide Openeye Name: (2R)-2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(2-methoxyethyl)acetamide CAS Name: (2R)-2-[3-(1-azepanyl)-2-quinoxalinyl]-2-cyano-N-(2-methoxyethyl)acetamide IUPAC Name: (2R)-2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(2-methoxyethyl)acetamide Traditional Name: (2R)-2-[3-(azepan-1-yl)quinoxalin-2-yl]-2-cyano-N-(2-methoxyethyl)acetamide Formula: C20H25N5O2 MolecularWeight: 367.4448

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCCCC3

Isomeric SMILES

COCCNC(=O)[C@@H](C#N)C1=NC2=CC=CC=C2N=C1N3CCCCCC3

InChI

InChI=1S/C20H25N5O2/c1-27-13-10-22-20(26)15(14-21)18-19(25-11-6-2-3-7-12-25)24-17-9-5-4-8-16(17)23-18/h4-5,8-9,15H,2-3,6-7,10-13H2,1H3,(H,22,26)/t15-/m0/s1