5-[9-ethyl-6-morpholin-4-yl-8-[(4-piperidin-1-ylpiperidin-1-yl)methyl]purin-2-yl]-4-methyl-pyrimidin-2-amine

Systemtic Name: 5-[9-ethyl-6-morpholin-4-yl-8-[(4-piperidin-1-ylpiperidin-1-yl)methyl]purin-2-yl]-4-methyl-pyrimidin-2-amine Openeye Name: 5-[9-ethyl-6-morpholino-8-[[4-(1-piperidyl)-1-piperidyl]methyl]purin-2-yl]-4-methyl-pyrimidin-2-amine CAS Name: 5-[9-ethyl-6-(4-morpholinyl)-8-[[4-(1-piperidinyl)-1-piperidinyl]methyl]-2-purinyl]-4-methyl-2-pyrimidinamine IUPAC Name: 5-[9-ethyl-6-morpholin-4-yl-8-[(4-piperidin-1-ylpiperidin-1-yl)methyl]purin-2-yl]-4-methylpyrimidin-2-amine Traditional Name: [5-[9-ethyl-6-morpholino-8-[(4-piperidinopiperidino)methyl]purin-2-yl]-4-methyl-pyrimidin-2-yl]amine Formula: C27H40N10O MolecularWeight: 520.6729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1N=C(N=C2N3CCOCC3)C4=CN=C(N=C4C)N)CN5CCC(CC5)N6CCCCC6

Isomeric SMILES

CCN1C(=NC2=C1N=C(N=C2N3CCOCC3)C4=CN=C(N=C4C)N)CN5CCC(CC5)N6CCCCC6

InChI

InChI=1S/C27H40N10O/c1-3-37-22(18-34-11-7-20(8-12-34)35-9-5-4-6-10-35)31-23-25(36-13-15-38-16-14-36)32-24(33-26(23)37)21-17-29-27(28)30-19(21)2/h17,20H,3-16,18H2,1-2H3,(H2,28,29,30)