2-methoxy-9-(methylsulfanylmethyl)-6-piperazin-1-yl-purine

Systemtic Name: 2-methoxy-9-(methylsulfanylmethyl)-6-piperazin-1-yl-purine Openeye Name: 2-methoxy-9-(methylsulfanylmethyl)-6-piperazin-1-yl-purine CAS Name: 2-methoxy-9-[(methylthio)methyl]-6-(1-piperazinyl)purine IUPAC Name: 2-methoxy-9-(methylsulfanylmethyl)-6-piperazin-1-ylpurine Traditional Name: 2-methoxy-9-[(methylthio)methyl]-6-piperazino-purine Formula: C12H18N6OS MolecularWeight: 294.37592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C(=N1)N3CCNCC3)N=CN2CSC

Isomeric SMILES

COC1=NC2=C(C(=N1)N3CCNCC3)N=CN2CSC

InChI

InChI=1S/C12H18N6OS/c1-19-12-15-10(17-5-3-13-4-6-17)9-11(16-12)18(7-14-9)8-20-2/h7,13H,3-6,8H2,1-2H3