9-cyclopentyl-6-[[2-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]amino]purine-2-carbonitrile

Systemtic Name: 9-cyclopentyl-6-[[2-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]amino]purine-2-carbonitrile Openeye Name: 9-cyclopentyl-6-[2-[3-(4-methylpiperazin-1-yl)propoxy]anilino]purine-2-carbonitrile CAS Name: 9-cyclopentyl-6-[2-[3-(4-methyl-1-piperazinyl)propoxy]anilino]-2-purinecarbonitrile IUPAC Name: 9-cyclopentyl-6-[2-[3-(4-methylpiperazin-1-yl)propoxy]anilino]purine-2-carbonitrile Traditional Name: 9-cyclopentyl-6-[2-[3-(4-methylpiperazino)propoxy]anilino]purine-2-carbonitrile Formula: C25H32N8O MolecularWeight: 460.57458

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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/C25H32N8O/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/h4-5,9-10,18-19H,2-3,6-8,11-16H2,1H3,(H,28,29,30)