N2-(4-methoxyphenyl)-N6-(phenylmethyl)-9-propan-2-yl-purine-2,6-diamine

Systemtic Name: N2-(4-methoxyphenyl)-N6-(phenylmethyl)-9-propan-2-yl-purine-2,6-diamine Openeye Name: N6-benzyl-9-isopropyl-N2-(4-methoxyphenyl)purine-2,6-diamine CAS Name: N2-(4-methoxyphenyl)-N6-(phenylmethyl)-9-propan-2-ylpurine-2,6-diamine IUPAC Name: 6-N-benzyl-2-N-(4-methoxyphenyl)-9-propan-2-ylpurine-2,6-diamine Traditional Name: benzyl-[9-isopropyl-2-(p-anisidino)purin-6-yl]amine Formula: C22H24N6O MolecularWeight: 388.46556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCC3=CC=CC=C3)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H24N6O/c1-15(2)28-14-24-19-20(23-13-16-7-5-4-6-8-16)26-22(27-21(19)28)25-17-9-11-18(29-3)12-10-17/h4-12,14-15H,13H2,1-3H3,(H2,23,25,26,27)