N-(1-adamantyl)-1-[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]piperidine-4-carboxamide

Systemtic Name: N-(1-adamantyl)-1-[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]piperidine-4-carboxamide Openeye Name: N-(1-adamantyl)-1-[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]piperidine-4-carboxamide CAS Name: N-(1-adamantyl)-1-[4-(dimethylamino)-6-methyl-2-pyrimidinyl]-4-piperidinecarboxamide IUPAC Name: N-(1-adamantyl)-1-[4-(dimethylamino)-6-methylpyrimidin-2-yl]piperidine-4-carboxamide Traditional Name: N-(1-adamantyl)-1-[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]isonipecotamide Formula: C23H35N5O MolecularWeight: 397.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCC(CC2)C(=O)NC34CC5CC(C3)CC(C5)C4)N(C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC(CC2)C(=O)NC34CC5CC(C3)CC(C5)C4)N(C)C

InChI

InChI=1S/C23H35N5O/c1-15-8-20(27(2)3)25-22(24-15)28-6-4-19(5-7-28)21(29)26-23-12-16-9-17(13-23)11-18(10-16)14-23/h8,16-19H,4-7,9-14H2,1-3H3,(H,26,29)