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

Systemtic Name: 2-methyl-9-[3-[4-(2-methylphenyl)piperazin-1-yl]propyl]purin-6-amine Openeye Name: 2-methyl-9-[3-[4-(o-tolyl)piperazin-1-yl]propyl]purin-6-amine CAS Name: 2-methyl-9-[3-[4-(2-methylphenyl)-1-piperazinyl]propyl]-6-purinamine IUPAC Name: 2-methyl-9-[3-[4-(2-methylphenyl)piperazin-1-yl]propyl]purin-6-amine Traditional Name: [2-methyl-9-[3-[4-(o-tolyl)piperazino]propyl]purin-6-yl]amine Formula: C20H27N7 MolecularWeight: 365.47528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CCCN3C=NC4=C3N=C(N=C4N)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CCCN3C=NC4=C3N=C(N=C4N)C

InChI

InChI=1S/C20H27N7/c1-15-6-3-4-7-17(15)26-12-10-25(11-13-26)8-5-9-27-14-22-18-19(21)23-16(2)24-20(18)27/h3-4,6-7,14H,5,8-13H2,1-2H3,(H2,21,23,24)