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

Systemtic Name: 2-methylsulfanyl-9-(oxolan-2-yl)-6-(4-phenylpiperazin-1-yl)purine Openeye Name: 2-methylsulfanyl-6-(4-phenylpiperazin-1-yl)-9-tetrahydrofuran-2-yl-purine CAS Name: 2-(methylthio)-9-(2-oxolanyl)-6-(4-phenyl-1-piperazinyl)purine IUPAC Name: 2-methylsulfanyl-9-(oxolan-2-yl)-6-(4-phenylpiperazin-1-yl)purine Traditional Name: 2-(methylthio)-6-(4-phenylpiperazino)-9-(tetrahydrofuryl)purine Formula: C20H24N6OS MolecularWeight: 396.50916

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C(=N1)N3CCN(CC3)C4=CC=CC=C4)N=CN2C5CCCO5

Isomeric SMILES

CSC1=NC2=C(C(=N1)N3CCN(CC3)C4=CC=CC=C4)N=CN2C5CCCO5

InChI

InChI=1S/C20H24N6OS/c1-28-20-22-18(17-19(23-20)26(14-21-17)16-8-5-13-27-16)25-11-9-24(10-12-25)15-6-3-2-4-7-15/h2-4,6-7,14,16H,5,8-13H2,1H3