1-[[6-[(4-methylphenyl)methylamino]-9-propan-2-yl-purin-2-yl]-(2-oxidanylpropyl)amino]propan-2-ol

Systemtic Name: 1-[[6-[(4-methylphenyl)methylamino]-9-propan-2-yl-purin-2-yl]-(2-oxidanylpropyl)amino]propan-2-ol Openeye Name: 1-[2-hydroxypropyl-[9-isopropyl-6-(p-tolylmethylamino)purin-2-yl]amino]propan-2-ol CAS Name: 1-[2-hydroxypropyl-[6-[(4-methylphenyl)methylamino]-9-propan-2-yl-2-purinyl]amino]-2-propanol IUPAC Name: 1-[2-hydroxypropyl-[6-[(4-methylphenyl)methylamino]-9-propan-2-ylpurin-2-yl]amino]propan-2-ol Traditional Name: 1-[2-hydroxypropyl-[9-isopropyl-6-[(4-methylbenzyl)amino]purin-2-yl]amino]propan-2-ol Formula: C22H32N6O2 MolecularWeight: 412.52848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC(=NC3=C2N=CN3C(C)C)N(CC(C)O)CC(C)O

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC(=NC3=C2N=CN3C(C)C)N(CC(C)O)CC(C)O

InChI

InChI=1S/C22H32N6O2/c1-14(2)28-13-24-19-20(23-10-18-8-6-15(3)7-9-18)25-22(26-21(19)28)27(11-16(4)29)12-17(5)30/h6-9,13-14,16-17,29-30H,10-12H2,1-5H3,(H,23,25,26)