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

Systemtic Name: N-[4-[2-(5-cyano-1,3-dihydroisoindol-2-yl)ethyl]cyclohexyl]quinoline-4-carboxamide Openeye Name: N-[4-[2-(5-cyanoisoindolin-2-yl)ethyl]cyclohexyl]quinoline-4-carboxamide CAS Name: N-[4-[2-(5-cyano-1,3-dihydroisoindol-2-yl)ethyl]cyclohexyl]-4-quinolinecarboxamide IUPAC Name: N-[4-[2-(5-cyano-1,3-dihydroisoindol-2-yl)ethyl]cyclohexyl]quinoline-4-carboxamide Traditional Name: N-[4-[2-(5-cyanoisoindolin-2-yl)ethyl]cyclohexyl]cinchoninamide Formula: C27H28N4O MolecularWeight: 424.53742

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCN2CC3=C(C2)C=C(C=C3)C#N)NC(=O)C4=CC=NC5=CC=CC=C45

Isomeric SMILES

C1CC(CCC1CCN2CC3=C(C2)C=C(C=C3)C#N)NC(=O)C4=CC=NC5=CC=CC=C45

InChI

InChI=1S/C27H28N4O/c28-16-20-5-8-21-17-31(18-22(21)15-20)14-12-19-6-9-23(10-7-19)30-27(32)25-11-13-29-26-4-2-1-3-24(25)26/h1-5,8,11,13,15,19,23H,6-7,9-10,12,14,17-18H2,(H,30,32)