3-[dimethoxy(phenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)purin-6-amine hydrochloride

Systemtic Name: 3-[dimethoxy(phenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)purin-6-amine hydrochloride Openeye Name: 8-(1-benzyloxy-1-methyl-ethyl)-3-[dimethoxy(phenyl)methyl]purin-6-amine hydrochloride CAS Name: 3-[dimethoxy(phenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)-6-purinamine hydrochloride IUPAC Name: 3-[dimethoxy(phenyl)methyl]-8-(2-phenylmethoxypropan-2-yl)purin-6-amine hydrochloride Traditional Name: [8-(1-benzoxy-1-methyl-ethyl)-3-[dimethoxy(phenyl)methyl]purin-6-yl]amine hydrochloride Formula: C24H28ClN5O3 MolecularWeight: 469.96382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=NC2=C(N=CN(C2=N1)C(C3=CC=CC=C3)(OC)OC)N)OCC4=CC=CC=C4.Cl

Isomeric SMILES

CC(C)(C1=NC2=C(N=CN(C2=N1)C(C3=CC=CC=C3)(OC)OC)N)OCC4=CC=CC=C4.Cl

InChI

InChI=1S/C24H27N5O3.ClH/c1-23(2,32-15-17-11-7-5-8-12-17)22-27-19-20(25)26-16-29(21(19)28-22)24(30-3,31-4)18-13-9-6-10-14-18;/h5-14,16H,15,25H2,1-4H3;1H