(2S)-2-cyano-N-cyclohexyl-2-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]quinoxalin-2-yl]ethanamide

Systemtic Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]quinoxalin-2-yl]ethanamide Openeye Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3R,5R)-3,5-dimethyl-1-piperidyl]quinoxalin-2-yl]acetamide CAS Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-2-quinoxalinyl]acetamide IUPAC Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]quinoxalin-2-yl]acetamide Traditional Name: (2S)-2-cyano-N-cyclohexyl-2-[3-[(3R,5R)-3,5-dimethylpiperidino]quinoxalin-2-yl]acetamide Formula: C24H31N5O MolecularWeight: 405.53584

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NC4CCCCC4)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C2=NC3=CC=CC=C3N=C2[C@@H](C#N)C(=O)NC4CCCCC4)C

InChI

InChI=1S/C24H31N5O/c1-16-12-17(2)15-29(14-16)23-22(27-20-10-6-7-11-21(20)28-23)19(13-25)24(30)26-18-8-4-3-5-9-18/h6-7,10-11,16-19H,3-5,8-9,12,14-15H2,1-2H3,(H,26,30)/t16-,17-,19-/m1/s1