9-methyl-6-methylsulfanyl-9H-purin-9-ium

Systemtic Name: 9-methyl-6-methylsulfanyl-9H-purin-9-ium Openeye Name: 9-methyl-6-methylsulfanyl-9H-purin-9-ium CAS Name: 9-methyl-6-(methylthio)-9H-purin-9-ium IUPAC Name: 9-methyl-6-methylsulfanyl-9H-purin-9-ium Traditional Name: 9-methyl-6-(methylthio)-9H-purin-9-ium Formula: C7H9N4S+ MolecularWeight: 181.23816

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1C=NC2=C1N=CN=C2SC

Isomeric SMILES

C[NH+]1C=NC2=C1N=CN=C2SC

InChI

InChI=1S/C7H8N4S/c1-11-4-10-5-6(11)8-3-9-7(5)12-2/h3-4H,1-2H3/p+1