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

Systemtic Name: 2-[3-methyl-7-nonyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanamide Openeye Name: 2-(3-methyl-7-nonyl-2,6-dioxo-purin-8-yl)sulfanylacetamide CAS Name: 2-[(3-methyl-7-nonyl-2,6-dioxo-8-purinyl)thio]acetamide IUPAC Name: 2-(3-methyl-7-nonyl-2,6-dioxopurin-8-yl)sulfanylacetamide Traditional Name: 2-[(2,6-diketo-3-methyl-7-nonyl-purin-8-yl)thio]acetamide Formula: C17H27N5O3S MolecularWeight: 381.49298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)NC2=O)C

InChI

InChI=1S/C17H27N5O3S/c1-3-4-5-6-7-8-9-10-22-13-14(19-17(22)26-11-12(18)23)21(2)16(25)20-15(13)24/h3-11H2,1-2H3,(H2,18,23)(H,20,24,25)