9-[1-[8-methyl-2-(4-methylpiperazin-1-yl)quinolin-3-yl]ethyl]purin-6-amine

Systemtic Name: 9-[1-[8-methyl-2-(4-methylpiperazin-1-yl)quinolin-3-yl]ethyl]purin-6-amine Openeye Name: 9-[1-[8-methyl-2-(4-methylpiperazin-1-yl)-3-quinolyl]ethyl]purin-6-amine CAS Name: 9-[1-[8-methyl-2-(4-methyl-1-piperazinyl)-3-quinolinyl]ethyl]-6-purinamine IUPAC Name: 9-[1-[8-methyl-2-(4-methylpiperazin-1-yl)quinolin-3-yl]ethyl]purin-6-amine Traditional Name: [9-[1-[8-methyl-2-(4-methylpiperazino)-3-quinolyl]ethyl]purin-6-yl]amine Formula: C22H26N8 MolecularWeight: 402.49544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)N3CCN(CC3)C)C(C)N4C=NC5=C4N=CN=C5N

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)N3CCN(CC3)C)C(C)N4C=NC5=C4N=CN=C5N

InChI

InChI=1S/C22H26N8/c1-14-5-4-6-16-11-17(21(27-18(14)16)29-9-7-28(3)8-10-29)15(2)30-13-26-19-20(23)24-12-25-22(19)30/h4-6,11-13,15H,7-10H2,1-3H3,(H2,23,24,25)