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

Systemtic Name: 2-methyl-9-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]purin-6-amine Openeye Name: 2-methyl-9-[3-[4-(m-tolyl)piperazin-1-yl]propyl]purin-6-amine CAS Name: 2-methyl-9-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-6-purinamine IUPAC Name: 2-methyl-9-[3-[4-(3-methylphenyl)piperazin-1-yl]propyl]purin-6-amine Traditional Name: [2-methyl-9-[3-[4-(m-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=C1)N2CCN(CC2)CCCN3C=NC4=C3N=C(N=C4N)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCCN3C=NC4=C3N=C(N=C4N)C

InChI

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