N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-2-quinoxalin-6-yl-ethanamide

Systemtic Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-2-quinoxalin-6-yl-ethanamide Openeye Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-2-quinoxalin-6-yl-acetamide CAS Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-2-(6-quinoxalinyl)acetamide IUPAC Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-2-quinoxalin-6-ylacetamide Traditional Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-2-quinoxalin-6-yl-acetamide Formula: C29H33N5O MolecularWeight: 467.60522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCN2CCC3=C(CC2)C=C(C=C3)C#N)NC(=O)CC4=CC5=NC=CN=C5C=C4

Isomeric SMILES

C1CC(CCC1CCN2CCC3=C(CC2)C=C(C=C3)C#N)NC(=O)CC4=CC5=NC=CN=C5C=C4

InChI

InChI=1S/C29H33N5O/c30-20-23-1-5-24-10-15-34(16-11-25(24)17-23)14-9-21-2-6-26(7-3-21)33-29(35)19-22-4-8-27-28(18-22)32-13-12-31-27/h1,4-5,8,12-13,17-18,21,26H,2-3,6-7,9-11,14-16,19H2,(H,33,35)