9-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-methyl-purin-6-amine

Systemtic Name: 9-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-methyl-purin-6-amine Openeye Name: 9-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-methyl-purin-6-amine CAS Name: 9-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-2-methyl-6-purinamine IUPAC Name: 9-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-methylpurin-6-amine Traditional Name: [9-[3-[4-(4-methoxyphenyl)piperazino]propyl]-2-methyl-purin-6-yl]amine Formula: C20H27N7O MolecularWeight: 381.47468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N)N=CN2CCCN3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC2=C(C(=N1)N)N=CN2CCCN3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H27N7O/c1-15-23-19(21)18-20(24-15)27(14-22-18)9-3-8-25-10-12-26(13-11-25)16-4-6-17(28-2)7-5-16/h4-7,14H,3,8-13H2,1-2H3,(H2,21,23,24)