[3-[9-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-6-morpholin-4-yl-purin-2-yl]phenyl]methanol

Systemtic Name: [3-[9-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-6-morpholin-4-yl-purin-2-yl]phenyl]methanol Openeye Name: [3-[9-[1-(1H-imidazol-2-ylmethyl)-4-piperidyl]-6-morpholino-purin-2-yl]phenyl]methanol CAS Name: [3-[9-[1-(1H-imidazol-2-ylmethyl)-4-piperidinyl]-6-(4-morpholinyl)-2-purinyl]phenyl]methanol IUPAC Name: [3-[9-[1-(1H-imidazol-2-ylmethyl)piperidin-4-yl]-6-morpholin-4-ylpurin-2-yl]phenyl]methanol Traditional Name: [3-[9-[1-(1H-imidazol-2-ylmethyl)-4-piperidyl]-6-morpholino-purin-2-yl]phenyl]methanol Formula: C25H30N8O2 MolecularWeight: 474.5581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=NC3=C2N=C(N=C3N4CCOCC4)C5=CC(=CC=C5)CO)CC6=NC=CN6

Isomeric SMILES

C1CN(CCC1N2C=NC3=C2N=C(N=C3N4CCOCC4)C5=CC(=CC=C5)CO)CC6=NC=CN6

InChI

InChI=1S/C25H30N8O2/c34-16-18-2-1-3-19(14-18)23-29-24(32-10-12-35-13-11-32)22-25(30-23)33(17-28-22)20-4-8-31(9-5-20)15-21-26-6-7-27-21/h1-3,6-7,14,17,20,34H,4-5,8-13,15-16H2,(H,26,27)