4-cyclobutyl-2-[3-(hydroxymethyl)morpholin-4-yl]-N-(5-oxidanyl-2-adamantyl)pyrimidine-5-carboxamide

Systemtic Name: 4-cyclobutyl-2-[3-(hydroxymethyl)morpholin-4-yl]-N-(5-oxidanyl-2-adamantyl)pyrimidine-5-carboxamide Openeye Name: 4-cyclobutyl-N-(5-hydroxy-2-adamantyl)-2-[3-(hydroxymethyl)morpholin-4-yl]pyrimidine-5-carboxamide CAS Name: 4-cyclobutyl-N-(5-hydroxy-2-adamantyl)-2-[3-(hydroxymethyl)-4-morpholinyl]-5-pyrimidinecarboxamide IUPAC Name: 4-cyclobutyl-N-(5-hydroxy-2-adamantyl)-2-[3-(hydroxymethyl)morpholin-4-yl]pyrimidine-5-carboxamide Traditional Name: 4-cyclobutyl-N-(5-hydroxy-2-adamantyl)-2-(3-methylolmorpholino)pyrimidine-5-carboxamide Formula: C24H34N4O4 MolecularWeight: 442.55116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C2=NC(=NC=C2C(=O)NC3C4CC5CC3CC(C5)(C4)O)N6CCOCC6CO

Isomeric SMILES

C1CC(C1)C2=NC(=NC=C2C(=O)NC3C4CC5CC3CC(C5)(C4)O)N6CCOCC6CO

InChI

InChI=1S/C24H34N4O4/c29-12-18-13-32-5-4-28(18)23-25-11-19(21(27-23)15-2-1-3-15)22(30)26-20-16-6-14-7-17(20)10-24(31,8-14)9-16/h11,14-18,20,29,31H,1-10,12-13H2,(H,26,30)