2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl-dimethyl-sulfanium iodide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethyl-dimethyl-sulfanium iodide Openeye Name: 2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethyl-dimethyl-sulfonium iodide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)ethyl-dimethylsulfonium iodide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl-dimethylsulfanium iodide Traditional Name: 2-(2,6-diketo-1,3-dimethyl-purin-7-yl)ethyl-dimethyl-sulfonium iodide Formula: C11H17IN4O2S MolecularWeight: 396.24775

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC[S+](C)C.[I-]

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC[S+](C)C.[I-]

InChI

InChI=1S/C11H17N4O2S.HI/c1-13-9-8(10(16)14(2)11(13)17)15(7-12-9)5-6-18(3)4;/h7H,5-6H2,1-4H3;1H/q+1;/p-1