1-(2-azanyl-6-morpholin-4-yl-pyrimidin-4-yl)-N-(3-methylcyclohexyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-azanyl-6-morpholin-4-yl-pyrimidin-4-yl)-N-(3-methylcyclohexyl)piperidine-4-carboxamide Openeye Name: 1-(2-amino-6-morpholino-pyrimidin-4-yl)-N-(3-methylcyclohexyl)piperidine-4-carboxamide CAS Name: 1-[2-amino-6-(4-morpholinyl)-4-pyrimidinyl]-N-(3-methylcyclohexyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-amino-6-morpholin-4-ylpyrimidin-4-yl)-N-(3-methylcyclohexyl)piperidine-4-carboxamide Traditional Name: 1-(2-amino-6-morpholino-pyrimidin-4-yl)-N-(3-methylcyclohexyl)isonipecotamide Formula: C21H34N6O2 MolecularWeight: 402.53366

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)NC(=O)C2CCN(CC2)C3=CC(=NC(=N3)N)N4CCOCC4

Isomeric SMILES

CC1CCCC(C1)NC(=O)C2CCN(CC2)C3=CC(=NC(=N3)N)N4CCOCC4

InChI

InChI=1S/C21H34N6O2/c1-15-3-2-4-17(13-15)23-20(28)16-5-7-26(8-6-16)18-14-19(25-21(22)24-18)27-9-11-29-12-10-27/h14-17H,2-13H2,1H3,(H,23,28)(H2,22,24,25)