2-[1,3,9-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanamide

Systemtic Name: 2-[1,3,9-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanamide Openeye Name: 2-(1,3,9-trimethyl-2,6-dioxo-purin-8-yl)sulfanylacetamide CAS Name: 2-[(1,3,9-trimethyl-2,6-dioxo-8-purinyl)thio]acetamide IUPAC Name: 2-(1,3,9-trimethyl-2,6-dioxopurin-8-yl)sulfanylacetamide Traditional Name: 2-[(2,6-diketo-1,3,9-trimethyl-purin-8-yl)thio]acetamide Formula: C10H13N5O3S MolecularWeight: 283.30692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1SCC(=O)N

Isomeric SMILES

CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1SCC(=O)N

InChI

InChI=1S/C10H13N5O3S/c1-13-7-6(12-9(13)19-4-5(11)16)8(17)15(3)10(18)14(7)2/h4H2,1-3H3,(H2,11,16)