6-(4-methylpiperazin-1-yl)-2-methylsulfanyl-9-(oxolan-2-yl)purine

Systemtic Name: 6-(4-methylpiperazin-1-yl)-2-methylsulfanyl-9-(oxolan-2-yl)purine Openeye Name: 6-(4-methylpiperazin-1-yl)-2-methylsulfanyl-9-tetrahydrofuran-2-yl-purine CAS Name: 6-(4-methyl-1-piperazinyl)-2-(methylthio)-9-(2-oxolanyl)purine IUPAC Name: 6-(4-methylpiperazin-1-yl)-2-methylsulfanyl-9-(oxolan-2-yl)purine Traditional Name: 6-(4-methylpiperazino)-2-(methylthio)-9-(tetrahydrofuryl)purine Formula: C15H22N6OS MolecularWeight: 334.43978

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC3=C2N=CN3C4CCCO4)SC

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC3=C2N=CN3C4CCCO4)SC

InChI

InChI=1S/C15H22N6OS/c1-19-5-7-20(8-6-19)13-12-14(18-15(17-13)23-2)21(10-16-12)11-4-3-9-22-11/h10-11H,3-9H2,1-2H3