5-methyl-4-(3-morpholin-4-ylpropylamino)-N-(5-oxidanyl-2-adamantyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 5-methyl-4-(3-morpholin-4-ylpropylamino)-N-(5-oxidanyl-2-adamantyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(5-hydroxy-2-adamantyl)-5-methyl-4-(3-morpholinopropylamino)thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(5-hydroxy-2-adamantyl)-5-methyl-4-[3-(4-morpholinyl)propylamino]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(5-hydroxy-2-adamantyl)-5-methyl-4-(3-morpholin-4-ylpropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(5-hydroxy-2-adamantyl)-5-methyl-4-(3-morpholinopropylamino)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C25H35N5O3S MolecularWeight: 485.6421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCCN3CCOCC3)C(=O)NC4C5CC6CC4CC(C6)(C5)O

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCCN3CCOCC3)C(=O)NC4C5CC6CC4CC(C6)(C5)O

InChI

InChI=1S/C25H35N5O3S/c1-15-19-22(26-3-2-4-30-5-7-33-8-6-30)27-14-28-24(19)34-21(15)23(31)29-20-17-9-16-10-18(20)13-25(32,11-16)12-17/h14,16-18,20,32H,2-13H2,1H3,(H,29,31)(H,26,27,28)