2-[3-methyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanamide

Systemtic Name: 2-[3-methyl-7-(2-methylpropyl)-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanamide Openeye Name: 2-(7-isobutyl-3-methyl-2,6-dioxo-purin-8-yl)sulfanylacetamide CAS Name: 2-[[3-methyl-7-(2-methylpropyl)-2,6-dioxo-8-purinyl]thio]acetamide IUPAC Name: 2-[3-methyl-7-(2-methylpropyl)-2,6-dioxopurin-8-yl]sulfanylacetamide Traditional Name: 2-[(7-isobutyl-2,6-diketo-3-methyl-purin-8-yl)thio]acetamide Formula: C12H17N5O3S MolecularWeight: 311.36008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(N=C1SCC(=O)N)N(C(=O)NC2=O)C

Isomeric SMILES

CC(C)CN1C2=C(N=C1SCC(=O)N)N(C(=O)NC2=O)C

InChI

InChI=1S/C12H17N5O3S/c1-6(2)4-17-8-9(14-12(17)21-5-7(13)18)16(3)11(20)15-10(8)19/h6H,4-5H2,1-3H3,(H2,13,18)(H,15,19,20)