9-cyclopentyl-2-(iminomethyl)-N-[2-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]purin-6-amine

Systemtic Name: 9-cyclopentyl-2-(iminomethyl)-N-[2-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]purin-6-amine Openeye Name: 9-cyclopentyl-2-methanimidoyl-N-[2-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]purin-6-amine CAS Name: 9-cyclopentyl-2-methanimidoyl-N-[2-[3-(4-methyl-1-piperazinyl)propoxy]phenyl]-6-purinamine IUPAC Name: 9-cyclopentyl-2-methanimidoyl-N-[2-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]purin-6-amine Traditional Name: (9-cyclopentyl-2-formimidoyl-purin-6-yl)-[2-[3-(4-methylpiperazino)propoxy]phenyl]amine Formula: C25H34N8O MolecularWeight: 462.59046

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=CC=CC=C2NC3=NC(=NC4=C3N=CN4C5CCCC5)C=N

Isomeric SMILES

CN1CCN(CC1)CCCOC2=CC=CC=C2NC3=NC(=NC4=C3N=CN4C5CCCC5)C=N

InChI

InChI=1S/C25H34N8O/c1-31-12-14-32(15-13-31)11-6-16-34-21-10-5-4-9-20(21)28-24-23-25(30-22(17-26)29-24)33(18-27-23)19-7-2-3-8-19/h4-5,9-10,17-19,26H,2-3,6-8,11-16H2,1H3,(H,28,29,30)