7,9-dimethyl-2-methylsulfanyl-3H-purin-9-ium-6-thione

Systemtic Name: 7,9-dimethyl-2-methylsulfanyl-3H-purin-9-ium-6-thione Openeye Name: 7,9-dimethyl-2-methylsulfanyl-3H-purin-9-ium-6-thione CAS Name: 7,9-dimethyl-2-(methylthio)-3H-purin-9-ium-6-thione IUPAC Name: 7,9-dimethyl-2-methylsulfanyl-3H-purin-9-ium-6-thione Traditional Name: 7,9-dimethyl-2-(methylthio)-3H-purin-9-ium-6-thione Formula: C8H11N4S2+ MolecularWeight: 227.32974

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C2=C1C(=S)N=C(N2)SC)C

Isomeric SMILES

CN1C=[N+](C2=C1C(=S)N=C(N2)SC)C

InChI

InChI=1S/C8H10N4S2/c1-11-4-12(2)6-5(11)7(13)10-8(9-6)14-3/h4H,1-3H3/p+1