1-(2-azanyl-6-morpholin-4-yl-pyrimidin-4-yl)-N-cyclooctyl-piperidine-4-carboxamide

Systemtic Name: 1-(2-azanyl-6-morpholin-4-yl-pyrimidin-4-yl)-N-cyclooctyl-piperidine-4-carboxamide Openeye Name: 1-(2-amino-6-morpholino-pyrimidin-4-yl)-N-cyclooctyl-piperidine-4-carboxamide CAS Name: 1-[2-amino-6-(4-morpholinyl)-4-pyrimidinyl]-N-cyclooctyl-4-piperidinecarboxamide IUPAC Name: 1-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-N-cyclooctylpiperidine-4-carboxamide Traditional Name: 1-(2-amino-6-morpholino-pyrimidin-4-yl)-N-cyclooctyl-isonipecotamide Formula: C22H36N6O2 MolecularWeight: 416.56024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C2CCN(CC2)C3=CC(=NC(=N3)N)N4CCOCC4

Isomeric SMILES

C1CCCC(CCC1)NC(=O)C2CCN(CC2)C3=CC(=NC(=N3)N)N4CCOCC4

InChI

InChI=1S/C22H36N6O2/c23-22-25-19(16-20(26-22)28-12-14-30-15-13-28)27-10-8-17(9-11-27)21(29)24-18-6-4-2-1-3-5-7-18/h16-18H,1-15H2,(H,24,29)(H2,23,25,26)