5-[6-morpholin-4-yl-9-[1-(1H-pyrrol-2-ylmethyl)piperidin-4-yl]purin-2-yl]pyridin-3-ol

Systemtic Name: 5-[6-morpholin-4-yl-9-[1-(1H-pyrrol-2-ylmethyl)piperidin-4-yl]purin-2-yl]pyridin-3-ol Openeye Name: 5-[6-morpholino-9-[1-(1H-pyrrol-2-ylmethyl)-4-piperidyl]purin-2-yl]pyridin-3-ol CAS Name: 5-[6-(4-morpholinyl)-9-[1-(1H-pyrrol-2-ylmethyl)-4-piperidinyl]-2-purinyl]-3-pyridinol IUPAC Name: 5-[6-morpholin-4-yl-9-[1-(1H-pyrrol-2-ylmethyl)piperidin-4-yl]purin-2-yl]pyridin-3-ol Traditional Name: 5-[6-morpholino-9-[1-(1H-pyrrol-2-ylmethyl)-4-piperidyl]purin-2-yl]pyridin-3-ol Formula: C24H28N8O2 MolecularWeight: 460.53152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=NC3=C2N=C(N=C3N4CCOCC4)C5=CC(=CN=C5)O)CC6=CC=CN6

Isomeric SMILES

C1CN(CCC1N2C=NC3=C2N=C(N=C3N4CCOCC4)C5=CC(=CN=C5)O)CC6=CC=CN6

InChI

InChI=1S/C24H28N8O2/c33-20-12-17(13-25-14-20)22-28-23(31-8-10-34-11-9-31)21-24(29-22)32(16-27-21)19-3-6-30(7-4-19)15-18-2-1-5-26-18/h1-2,5,12-14,16,19,26,33H,3-4,6-11,15H2