N2,9-bis(3-methylphenyl)-6-(4-methylpiperidin-1-yl)purine-2,8-diamine

Systemtic Name: N2,9-bis(3-methylphenyl)-6-(4-methylpiperidin-1-yl)purine-2,8-diamine Openeye Name: 6-(4-methyl-1-piperidyl)-N2,9-bis(m-tolyl)purine-2,8-diamine CAS Name: N2,9-bis(3-methylphenyl)-6-(4-methyl-1-piperidinyl)purine-2,8-diamine IUPAC Name: 2-N,9-bis(3-methylphenyl)-6-(4-methylpiperidin-1-yl)purine-2,8-diamine Traditional Name: [8-amino-6-(4-methylpiperidino)-9-(m-tolyl)purin-2-yl]-(m-tolyl)amine Formula: C25H29N7 MolecularWeight: 427.54466

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=NC3=C2N=C(N3C4=CC=CC(=C4)C)N)NC5=CC=CC(=C5)C

Isomeric SMILES

CC1CCN(CC1)C2=NC(=NC3=C2N=C(N3C4=CC=CC(=C4)C)N)NC5=CC=CC(=C5)C

InChI

InChI=1S/C25H29N7/c1-16-10-12-31(13-11-16)22-21-23(30-25(29-22)27-19-8-4-6-17(2)14-19)32(24(26)28-21)20-9-5-7-18(3)15-20/h4-9,14-16H,10-13H2,1-3H3,(H2,26,28)(H,27,29,30)