2-[1-[6-(naphthalen-2-ylmethylamino)-9-propan-2-yl-purin-2-yl]piperidin-2-yl]ethanol

Systemtic Name: 2-[1-[6-(naphthalen-2-ylmethylamino)-9-propan-2-yl-purin-2-yl]piperidin-2-yl]ethanol Openeye Name: 2-[1-[9-isopropyl-6-(2-naphthylmethylamino)purin-2-yl]-2-piperidyl]ethanol CAS Name: 2-[1-[6-(2-naphthalenylmethylamino)-9-propan-2-yl-2-purinyl]-2-piperidinyl]ethanol IUPAC Name: 2-[1-[6-(naphthalen-2-ylmethylamino)-9-propan-2-ylpurin-2-yl]piperidin-2-yl]ethanol Traditional Name: 2-[1-[9-isopropyl-6-(2-naphthylmethylamino)purin-2-yl]-2-piperidyl]ethanol Formula: C26H32N6O MolecularWeight: 444.57188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC4=CC=CC=C4C=C3)N5CCCCC5CCO

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC4=CC=CC=C4C=C3)N5CCCCC5CCO

InChI

InChI=1S/C26H32N6O/c1-18(2)32-17-28-23-24(27-16-19-10-11-20-7-3-4-8-21(20)15-19)29-26(30-25(23)32)31-13-6-5-9-22(31)12-14-33/h3-4,7-8,10-11,15,17-18,22,33H,5-6,9,12-14,16H2,1-2H3,(H,27,29,30)