(2R)-2-cyano-N-cyclohexyl-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]ethanamide

Systemtic Name: (2R)-2-cyano-N-cyclohexyl-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]ethanamide Openeye Name: (2R)-2-cyano-N-cyclohexyl-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]acetamide CAS Name: (2R)-2-cyano-N-cyclohexyl-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-quinoxalinyl]acetamide IUPAC Name: (2R)-2-cyano-N-cyclohexyl-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]acetamide Traditional Name: (2R)-2-cyano-N-cyclohexyl-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]acetamide Formula: C26H27N5O MolecularWeight: 425.52548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C#N)C2=NC3=CC=CC=C3N=C2N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCC(CC1)NC(=O)[C@@H](C#N)C2=NC3=CC=CC=C3N=C2N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H27N5O/c27-16-21(26(32)28-20-10-2-1-3-11-20)24-25(30-23-13-7-6-12-22(23)29-24)31-15-14-18-8-4-5-9-19(18)17-31/h4-9,12-13,20-21H,1-3,10-11,14-15,17H2,(H,28,32)/t21-/m0/s1