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

Systemtic Name: [3-[6-morpholin-4-yl-9-[1-(1H-pyrrol-2-ylmethyl)piperidin-4-yl]purin-2-yl]phenyl]methanol Openeye Name: [3-[6-morpholino-9-[1-(1H-pyrrol-2-ylmethyl)-4-piperidyl]purin-2-yl]phenyl]methanol CAS Name: [3-[6-(4-morpholinyl)-9-[1-(1H-pyrrol-2-ylmethyl)-4-piperidinyl]-2-purinyl]phenyl]methanol IUPAC Name: [3-[6-morpholin-4-yl-9-[1-(1H-pyrrol-2-ylmethyl)piperidin-4-yl]purin-2-yl]phenyl]methanol Traditional Name: [3-[6-morpholino-9-[1-(1H-pyrrol-2-ylmethyl)-4-piperidyl]purin-2-yl]phenyl]methanol Formula: C26H31N7O2 MolecularWeight: 473.57004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N7O2/c34-17-19-3-1-4-20(15-19)24-29-25(32-11-13-35-14-12-32)23-26(30-24)33(18-28-23)22-6-9-31(10-7-22)16-21-5-2-8-27-21/h1-5,8,15,18,22,27,34H,6-7,9-14,16-17H2