2-[2-[[9-methyl-6-[(4-methylphenyl)amino]purin-2-yl]amino]ethoxy]ethanol

Systemtic Name: 2-[2-[[9-methyl-6-[(4-methylphenyl)amino]purin-2-yl]amino]ethoxy]ethanol Openeye Name: 2-[2-[[9-methyl-6-(4-methylanilino)purin-2-yl]amino]ethoxy]ethanol CAS Name: 2-[2-[[9-methyl-6-(4-methylanilino)-2-purinyl]amino]ethoxy]ethanol IUPAC Name: 2-[2-[[9-methyl-6-(4-methylanilino)purin-2-yl]amino]ethoxy]ethanol Traditional Name: 2-[2-[[9-methyl-6-(p-toluidino)purin-2-yl]amino]ethoxy]ethanol Formula: C17H22N6O2 MolecularWeight: 342.39558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3C)NCCOCCO

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3C)NCCOCCO

InChI

InChI=1S/C17H22N6O2/c1-12-3-5-13(6-4-12)20-15-14-16(23(2)11-19-14)22-17(21-15)18-7-9-25-10-8-24/h3-6,11,24H,7-10H2,1-2H3,(H2,18,20,21,22)