N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-[1-(2-methylsulfanylethyl)piperidin-4-yl]purine-2,6-diamine

Systemtic Name: N6-(4-azanylcyclohexyl)-9-cyclopentyl-N2-[1-(2-methylsulfanylethyl)piperidin-4-yl]purine-2,6-diamine Openeye Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[1-(2-methylsulfanylethyl)-4-piperidyl]purine-2,6-diamine CAS Name: N6-(4-aminocyclohexyl)-9-cyclopentyl-N2-[1-[2-(methylthio)ethyl]-4-piperidinyl]purine-2,6-diamine IUPAC Name: 6-N-(4-aminocyclohexyl)-9-cyclopentyl-2-N-[1-(2-methylsulfanylethyl)piperidin-4-yl]purine-2,6-diamine Traditional Name: (4-aminocyclohexyl)-[9-cyclopentyl-2-[[1-[2-(methylthio)ethyl]-4-piperidyl]amino]purin-6-yl]amine Formula: C24H40N8S MolecularWeight: 472.693

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Descriptors Computed from Structure

Canonical SMILES:

CSCCN1CCC(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

Isomeric SMILES

CSCCN1CCC(CC1)NC2=NC3=C(C(=N2)NC4CCC(CC4)N)N=CN3C5CCCC5

InChI

InChI=1S/C24H40N8S/c1-33-15-14-31-12-10-19(11-13-31)28-24-29-22(27-18-8-6-17(25)7-9-18)21-23(30-24)32(16-26-21)20-4-2-3-5-20/h16-20H,2-15,25H2,1H3,(H2,27,28,29,30)