N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]quinoline-5-carboxamide

Systemtic Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]quinoline-5-carboxamide Openeye Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]quinoline-5-carboxamide CAS Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]-5-quinolinecarboxamide IUPAC Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]quinoline-5-carboxamide Traditional Name: N-[4-[2-(7-cyano-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]quinoline-5-carboxamide Formula: C29H32N4O MolecularWeight: 452.59058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCN2CCC3=C(CC2)C=C(C=C3)C#N)NC(=O)C4=C5C=CC=NC5=CC=C4

Isomeric SMILES

C1CC(CCC1CCN2CCC3=C(CC2)C=C(C=C3)C#N)NC(=O)C4=C5C=CC=NC5=CC=C4

InChI

InChI=1S/C29H32N4O/c30-20-22-6-9-23-13-17-33(18-14-24(23)19-22)16-12-21-7-10-25(11-8-21)32-29(34)27-3-1-5-28-26(27)4-2-15-31-28/h1-6,9,15,19,21,25H,7-8,10-14,16-18H2,(H,32,34)