2-[2-hydroxyethyl-[6-[(4-methoxyphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]ethanol

Systemtic Name: 2-[2-hydroxyethyl-[6-[(4-methoxyphenyl)methylamino]-9-propan-2-yl-purin-2-yl]amino]ethanol Openeye Name: 2-[2-hydroxyethyl-[9-isopropyl-6-[(4-methoxyphenyl)methylamino]purin-2-yl]amino]ethanol CAS Name: 2-[2-hydroxyethyl-[6-[(4-methoxyphenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]ethanol IUPAC Name: 2-[2-hydroxyethyl-[6-[(4-methoxyphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]ethanol Traditional Name: 2-[2-hydroxyethyl-[9-isopropyl-6-(p-anisylamino)purin-2-yl]amino]ethanol Formula: C20H28N6O3 MolecularWeight: 400.47472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)N(CCO)CCO

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)N(CCO)CCO

InChI

InChI=1S/C20H28N6O3/c1-14(2)26-13-22-17-18(21-12-15-4-6-16(29-3)7-5-15)23-20(24-19(17)26)25(8-10-27)9-11-28/h4-7,13-14,27-28H,8-12H2,1-3H3,(H,21,23,24)