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

Systemtic Name: 2-[7-dodecyl-3-methyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanamide Openeye Name: 2-(7-dodecyl-3-methyl-2,6-dioxo-purin-8-yl)sulfanylacetamide CAS Name: 2-[(7-dodecyl-3-methyl-2,6-dioxo-8-purinyl)thio]acetamide IUPAC Name: 2-(7-dodecyl-3-methyl-2,6-dioxopurin-8-yl)sulfanylacetamide Traditional Name: 2-[(2,6-diketo-7-lauryl-3-methyl-purin-8-yl)thio]acetamide Formula: C20H33N5O3S MolecularWeight: 423.57272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)NC2=O)C

InChI

InChI=1S/C20H33N5O3S/c1-3-4-5-6-7-8-9-10-11-12-13-25-16-17(22-20(25)29-14-15(21)26)24(2)19(28)23-18(16)27/h3-14H2,1-2H3,(H2,21,26)(H,23,27,28)